TCOX14 Models for the Included Phases
Also see the listing at the end for Gas and IONIC_LIQ Phase.
| Name | Prototype | Strukturbericht | Pearson Symbol | Space Group | Info | Sublattices | Formula Unit |
|---|---|---|---|---|---|---|---|
| A1C1F2 | Unknown Structure | This is Al2O3.CaO.2Fe2O3 | 5 | (CA+2)1(AL+3)1(FE+3)2(AL+3, FE+3)3(O-2)10 | |||
| AF | FeGaO3 | oP40 | (33, Pna2_1) | This is Al2O3.Fe2O3. | 3 | (AL+3)2(FE+3)2(O-2)6 | |
| AL18B4O33 | Al5BO9 | oS60 | (36, Cmc2_1) | 3 | (AL+3)18(B+3)4(O-2)33 | ||
| AL2P6SI4O26 | Unknown Structure | 4 | (AL+3)2(P+5)6(SI+4)4(O-2)26 | ||||
| AL2S3 | alpha-Al2S3 | hP30 | (169, P6_1) | 2 | (AL)2(S)3 | ||
| AL2SIO4F | Unknown Structure | 4 | (AL+3)2(SI+4)1(O-2)4(F-1)2 | ||||
| AL3PO7 | Unknown Structure | 3 | (AL+3)3(P+5)1(O-2)7 | ||||
| AL4B2O9 | Al4B1.5[BO3]0.5O7.5 | mS124 | (12, C2/m) | 3 | (AL+3)4(B+3)2(O-2)9 | ||
| AL4C3_D71 | Al4C3 (D71) | D71 | hR7 | (166, R-3m) | 2 | (AL, SI)4(C)3 | |
| ALABANDITE | Rock Salt (NaCl, B1) | B1 | cF8 | (225, Fm-3m) | This is CaS (oldhamite), MnS (alabandite), (Ba,Mg,Gd,La,Zr)S. | 2 | (BA, CA, CO, CR, CU, FE, GD, LA, MG, MN, Y, ZR)1(S)1 |
| ALBITE_LOW | Albite (NaAlSi3O8, S68) | S68 | aP26 | (2, P-1) | This is low temperature albite (NaAlSi3O8). | 4 | (NA+1)1(AL+3)1(SI+4)3(O-2)8 |
| ALBITE_MONO | Sanidine (KAlSi3O8, S67) | S67 | mS52 | (12, C2/m) | This is monoclinic albite (NaAlSi3O8). | 4 | (NA+1)1(AL+3)1(SI+4)3(O-2)8 |
| ALF3_S2 | AlF3 | oS48 | (63, Cmcm) | 2 | (AL+3)1(F-1)3 | ||
| ALNB11O29 | (Ti0.17Nb0.83)12O29 | mS82 | (12, C2/m) | 3 | (AL+3)1(NB+5)11(O-2)29 | ||
| ALNB49O124 | Unknown Structure | 3 | (AL+3)1(NB+5)49(O-2)124 | ||||
| ALN_B4 | Wurtzite (ZnS, B4) | B4 | hP4 | (186, P6_3mc) | 2 | (AL)1(N)1 | |
| ALP3O9 | AlP3O9 | mS156 | (9, Cc) | This is (Al,Cr,Fe)P3O9 | 2 | (AL+3, CR+3, FE+3)1(PO3-1)3 | |
| ALPHA_SPINEL | Hausmannite (Mn3O4) | tI28 | (141, I4_1/amd) | With solubility of Al, Co, Cr, Cu, Fe, Mg and Ni. | 4 | (CO+2, CU+2, MG+2, MN+2, MN+3, NI+2)1(AL+3, CR+3, FE+3, MN+2, MN+3, VA)2(MN+2, VA)2(O-2)4 | |
| ALPO4_S1 | Al[AsO4] | hP18 | (152, P3_121) | This is (Al,Fe, Mn)PO4 with SiO2 solubility. | 2 | (AL+3, FE+3, MN+3, SI+4)1(PO4-3, SIO4-4)1 | |
| ALPO4_S2 | Al[PO4] | hP18 | (180, P6_222) | This is AlPO4 with SiO2 solubility. | 2 | (AL+3, SI+4)1(PO4-3, SIO4-4)1 | |
| ALPO4_S3 | AlPO4 low cristobalite type | oS24 | (20, C222_1) | This is AlPO4 with SiO2 solubility. | 2 | (AL+3, SI+4)1(PO4-3, SIO4-4)1 | |
| ANDALUSITE | Andalusite (Al2SiO5, S02) | S02 | oP32 | (58, Pnnm) | This is a high-pressure phase | 4 | (AL+3)1(AL+3)1(SI+4)1(O-2)5 |
| ANHYDRITE | Anhydrite (CaSO4, H01) | H01 | oS24 | (63, Cmcm) | This is (Ca,Cu,Fe,Mg,Mn,Ni)(SO4). | 2 | (CA+2, CO+2, CU+2, FE+2, MG+2, MN+2, NI+2)1(SO4-2)1 |
| ANILITE | Cu7S4 | oP44 | (62, Pnma) | This is Cu7S4, orthorhombic structure. | 2 | (CU)1.75(S)1 | |
| ANORTHITE | Ca(Al0.5Si0.5)4O8 | aP104 | (2, P-1) | This is high temp albite (NaAlSi3O8), KAlSi3O8 and anorthite (CaAl2Si2O8) | 5 | (CA+2, K+1, NA+1)1(AL+3)1(AL+3, SI+4)1(SI+4)2(O-2)8 | |
| APATITE | Fluorapatite [Ca5F(PO4)3, H57] | H57 | hP42 | (176, P6_3/m) | This is Ca2(Gd,Y)8(SiO4)6O2 and Mg2(Gd,Y)8(SiO4)6O2 | 4 | (CA+2, GD+3, MG+2, VA, Y+3, YB+3, ZR+4)4(GD+3, Y+3, YB+3)6(SIO4-4)6(O-2, VA)2 |
| B2O3 | B2O3 | hP15 | (152, P3_121) | 2 | (B+3)2(O-2)3 | ||
| B4C_D1G | B13C2 B4C (D1g) | D1g | hR15 | (166, R-3m) | 2 | (B11C, B12)1(B2, C2B, CB2)1 | |
| BA2AL2B8O17 | Unknown Structure | 4 | (BA+2)2(AL+3)2(B+3)8(O-2)17 | ||||
| BA2B10O17 | Ba2B10O17 | aP58 | (2, P-1) | 3 | (BA+2)2(B+3)10(O-2)17 | ||
| BA2B2O5 | BaB2O5 | mP171 | (2, P-1) | 3 | (BA+2)2(B+3)2(O-2)5 | ||
| BA2CA4SI3O12 | Unknown Structure | 4 | (BA+2)2(CA+2)4(SI+4)3(O-2)12 | ||||
| BA2CA6SI4O16 | Unknown Structure | 4 | (BA+2)2(CA+2)6(SI+4)4(O-2)16 | ||||
| BA2CASI2O8 | Unknown Structure | This is Ba2Ca(Ba,Ca)Si2O8 solid solution. | 5 | (BA+2)2(CA+2)1(BA+2, CA+2)1(SI+4)2(O-2)8 | |||
| BA2FE2O5 | Ba2Fe2O5 | mP126 | (14, P2_1/c) | 3 | (BA+2)2(FE+3)2(O-2)5 | ||
| BA2FE6O11 | Ba2Fe6O11 | oP76 | (58, Pnnm) | 3 | (BA+2)2(FE+3)6(O-2)11 | ||
| BA2P2O7_A | Sr2[P2O7] | oP44 | (62, Pnma) | 2 | (BA+2)2(P2O7-4)1 | ||
| BA2SI3O8 | Ba2Si3O8 | mP52 | (14, P2_1/c) | 3 | (BA+2)2(SI+4)3(O-2)8 | ||
| BA2SIO4 | Arcanite (K2SO4, H16) | H16 | oP28 | (62, Pnma) | 2 | (BA+2, CA+2)2(SIO4-4)1 | |
| BA2TI9O20 | Ba2Ti9O20 | aP124 | (2, P-1) | 3 | (BA+2)2(TI+4)9(O-2)20 | ||
| BA2TIO4 | Ca2[SiO4] | mP28 | (14, P2_1/c) | 3 | (BA+2)2(TI+4)1(O-2)4 | ||
| BA2Y2ZRO7 | Unknown Structure | 4 | (BA+2)2(Y+3)2(ZR+4)1(O-2)7 | ||||
| BA2ZRF8 | Ba2ZrF8 | oP44 | (62, Pnma) | 3 | (BA+2)2(ZR+4)1(F-1)8 | ||
| BA2ZRO4 | K2NiF4 | tI14 | (139, I4/mmm) | 3 | (BA+2)2(ZR+4)1(O-2)4 | ||
| BA3AL2O6 | Ba3Al2O6 | cP264 | (198, P2_13) | 3 | (BA+2, CA+2)3(AL+3)2(O-2)6 | ||
| BA3AL4B4O15 | Unknown Structure | 4 | (BA+2)3(AL+3)4(B+3)4(O-2)15 | ||||
| BA3B2O6 | Ba3[BO3]2 | oP196 | (55, Pbam) | 3 | (BA+2)3(B+3)2(O-2)6 | ||
| BA3B6SI2O16 | Ba3(sI0.33B0.67)6b2O16 | aP29 | (2, P-1) | 4 | (BA+2)3(B+3)6(SI+4)2(O-2)16 | ||
| BA3CR2O6 | Unknown Structure | 3 | (BA+2)3(CR+3)2(O-2)6 | ||||
| BA3FE2O6 | Unknown Structure | 3 | (BA+2)3(FE+3)2(O-2)6 | ||||
| BA3GD4O9 | Unknown Structure | 3 | (BA+2)3(GD+3)4(O-2)9 | ||||
| BA3NIO4 | Ba3NiO4 | hR48 | (167, R-3c) | 3 | (BA+2)3(NI+2)1(O-2)4 | ||
| BA3P2O8_A | Ba3[PO4]2 | hR39 | (166, R-3m) | 2 | (BA+2, CA+2)3(PO4-3)2 | ||
| BA3P4O13_LT | Ba3P4O13 | aP40 | (2, P-1) | 3 | (BA+2)3(PO3-1)4(O-2)1 | ||
| BA3SI5O13 | Ba3Si5O13 | mP84 | (14, P2_1/c) | 3 | (BA+2)3(SI+4)5(O-2)13 | ||
| BA3SIO5 | Cs3CoCl5 (K31) | K31 | tI36 | (140, I4/mcm) | 3 | (BA+2)3(SI+4)1(O-2)5 | |
| BA3YB4O9 | Ba3Yb4O9 | hR48 | (146, R3) | 3 | (BA+2)3(Y+3, YB+3)4(O-2)9 | ||
| BA3ZR2O7 | Unknown Structure | 3 | (BA+2)3(ZR+4)2(O-2)7 | ||||
| BA3ZRF10 | Ba3ZrF10 | oS56 | (63, Cmcm) | 3 | (BA+2)3(ZR+4)1(F-1)10 | ||
| BA4AL2O7 | Ba4Al2O7 | oS208 | (64, Cmce) | 3 | (BA+2, CA+2)4(AL+3)2(O-2)7 | ||
| BA4B2O7 | Unknown Structure | 3 | (BA+2)4(B+3)2(O-2)7 | ||||
| BA4P2O9 | Unknown Structure | 3 | (BA+2)4(PO4-3)2(O-2)1 | ||||
| BA4TI13O30 | Ba4Ti13O30 | oS188 | (64, Cmce) | 3 | (BA+2)4(TI+4)13(O-2)30 | ||
| BA4Y2ZR2O11 | Unknown Structure | 4 | (BA+2)4(Y+3)2(ZR+4)2(O-2)11 | ||||
| BA5AL4B12O29 | Unknown Structure | 4 | (BA+2)5(AL+3)4(B+3)12(O-2)29 | ||||
| BA5B4O11 | Ba5B2[BO3]2O5 | oP240 | (19, P2_12_12_1) | 3 | (BA+2)5(B+3)4(O-2)11 | ||
| BA5SI8O21 | Ba5Si8O21 | mS136 | (15, C2/c) | 3 | (BA+2)5(SI+4)8(O-2)21 | ||
| BA6TI17O40 | Ba6Ti17O40 | mS252 | (15, C2/c) | 3 | (BA+2)6(TI+4)17(O-2)40 | ||
| BA7AL2O10 | Ba7Al2O10 | oP19 | (62, Pnma) | 3 | (BA+2)7(AL+3)2(O-2)10 | ||
| BAAL2B2O7 | BaAl2[BO3]2O | hR36 | (155, R32) | 4 | (BA+2)1(AL+3)2(B+3)2(O-2)7 | ||
| BAAL2B4O10 | Unknown Structure | 4 | (BA+2)1(AL+3)2(B+3)4(O-2)10 | ||||
| BAAL2O4 | BaAl2O4 | hP56 | (173, P6_3) | 3 | (BA+2, CA+2)1(AL+3)2(O-2)4 | ||
| BAAL2SI2O8 | SrGa2[SiO4]2 | mS104 | (15, C2/c) | 4 | (BA+2)1(AL+3)2(SI+4)2(O-2)8 | ||
| BAB2O4_A | BaB2O4 | hR126 | (161, R3c) | 3 | (BA+2)1(B+3)2(O-2)4 | ||
| BAB2O4_B | BaB2O4 | hR126 | (167, R-3c) | 3 | (BA+2)1(B+3)2(O-2)4 | ||
| BAB4O7 | BaB4O7 | mP96 | (14, P2_1/c) | 3 | (BA+2)1(B+3)4(O-2)7 | ||
| BAB8O13 | BaB8O13 | tP88 | (91, P4_122) | 3 | (BA+2, CA+2)1(B+3)8(O-2)13 | ||
| BACA2AL8O15 | Unknown Structure | 4 | (BA+2)1(CA+2)2(AL+3)8(O-2)15 | ||||
| BACA2MGSI2O8 | BaAg2Mn[VO4]2 | hP14 | (147, P-3) | 5 | (BA+2, CA+2)1(BA+2, CA+2)2(MG+2)1(SI+4)2(O-2)8 | ||
| BACA2SI3O9 | BaCa2Si3O9 | aP30 | (2, P-1) | This is (Ba, Ca)CaSi3O9 solid solution. | 5 | (BA+2, CA+2)1(BA+2, CA+2)1(CA+2)1(SI+4)3(O-2)9 | |
| BACO3_S1 | Ca[CO3]-a | oP20 | (62, Pnma) | 2 | (BA+2)1(CO3-2)1 | ||
| BACO3_S2 | K[NO3] | hR15 | (160, R3m) | 2 | (BA+2)1(CO3-2)1 | ||
| BACO3_S3 | Rb[NO3] | cF184 | (225, Fm-3m) | 2 | (BA+2)1(CO3-2)1 | ||
| BAFE2O4 | BaFe2O4 | oS56 | (36, Cmc2_1) | 3 | (BA+2)1(FE+3)2(O-2)4 | ||
| BAMG2SI2O7 | BaCo2[Si2O7] | mS96 | (15, C2/c) | 4 | (BA+2)1(MG+2)2(SI+4)2(O-2)7 | ||
| BAMG3AL14O25 | Unknown Structure | 4 | (BA+2)1(MG+2)3(AL+3)14(O-2)25 | ||||
| BAMGF4 | BaZnF4 | oS24 | (36, Cmc2_1) | 3 | (BA+2)1(MG+2)1(F-1)4 | ||
| BAMGSI3O8 | Unknown Structure | 4 | (BA+2)1(MG+2)1(SI+4)3(O-2)8 | ||||
| BAMGSIO4 | BaZn[GeO4] | hP42 | (173, P6_3) | 3 | (BA+2)1(MG+2)1(SIO4-4)1 | ||
| BANIO2 | BaNiO2 | oS16 | (63, Cmcm) | 3 | (BA+2)1(NI+2)1(O-2)2 | ||
| BAO2 | CaC2-I (C11a) | C11a | tI6 | (139, I4/mmm) | 2 | (BA+4)1(O-2)2 | |
| BAP2O6 | BaP2O6 | oP36 | (19, P2_12_12_1) | 2 | (BA+2)1(PO3-1)2 | ||
| BASI2O5 | BaSi2O5 | oP32 | (62, Pnma) | 3 | (BA+2)1(SI+4)2(O-2)5 | ||
| BASIO3 | BaGeO3 | oP20 | (19, P2_12_12_1) | BaSiO3 with Ca solubility | 3 | (BA+2, CA+2)1(SI+4)1(O-2)3 | |
| BATI4O9 | BaTi4O9 | oP28 | (59, Pmmn) | 3 | (BA+2)1(TI+4)4(O-2)9 | ||
| BATIO3_C | BaTiO3 | tP5 | (99, P4mm) | 3 | (BA+2, VA)1(TI+4)1(O-2, VA)3 | ||
| BATIO3_H | Cubic Perovskite (CaTiO3, E21) | E21 | cP5 | (221, Pm-3m) | 3 | (BA+2, VA)1(TI+4)1(O-2, VA)3 | |
| BAZR2F10_A | BaZr2F10 | aP104 | (2, P-1) | 3 | (BA+2)1(ZR+4)2(F-1)10 | ||
| BAZR2F10_B | BaZr2F10 | mS52 | (15, C2/c) | 3 | (BA+2)1(ZR+4)2(F-1)10 | ||
| BAZRF6_A | BaZrF6 | mP32 | (14, P2_1/c) | 3 | (BA+2)1(ZR+4)1(F-1)6 | ||
| BAZRF6_B | ZrPbF6 | oS32 | (67, Cmme) | 3 | (BA+2)1(ZR+4)1(F-1)6 | ||
| BCC_A2 | Body-Centered Cubic (W, A2, bcc) | A2 | cI2 | (229, Im-3m) | 2 | (AL, BA, CA, CO, CR, CU, FE, GD, HF, K, LA, LI, MG, MN, MO, NA, NB, NI, P, S, SI, TI, V, W, Y, YB, ZR)1(B, C, N, O, VA)3 | |
| BCY | Unknown Structure | 4 | (BA+2, VA)0.1111(CA+2, Y+3)0.2222(Y+3)0.6667(O-2)1.3333 | ||||
| BETA_RHOMBO_B | beta-B (R-105) | hR105 | (166, R-3m) | 2 | (B)93(B, C, SI)12 | ||
| BETA_V_O | CoO | tI4 | (139, I4/mmm) | 2 | (V)1(O, VA)1 | ||
| BPO4 | BPO4 (H07) | H07 | tI12 | (82, I-4) | 3 | (B+3)1(P+5)1(O-2)4 | |
| BRONZE | Unknown Structure | 3 | (V+4, V+5)2(O-2)5(CA+2, FE+2, VA)1 | ||||
| C11A7F | Ca6Al7O16F | cI152 | (220, I-43d) | This is 11CaO.7Al2O3.CaF2 | 4 | (AL+3)14(CA+2)12(F-1)2(O-2)32 | |
| C12A7 | Mayenite (12CaO.7Al2O3, K74, C12A7) | K74 | cI152 | (220, I-43d) | Not stable under anhydrous conditions. | 4 | (CA+2)6(AL+3)6(AL+3, FE+3)1(O-2)16.5 |
| C13A6Z2 | Ca7ZrAl6O18 | oP104 | (31, Pmn2_1) | This is 13CaO.3Al2O3.2ZrO2. | 4 | (CA+2)13(AL+3)12(ZR+4)2(O-2)35 | |
| C1A1 | Al2CaO4 | mP84 | (14, P2_1/c) | This is CaO.Al2O3 with solubility of Ba and Fe | 4 | (BA+2, CA+2)3(AL+3)5(AL+3, FE+3)1(O-2)12 | |
| C1A2 | Al4CaO7 | mS48 | (15, C2/c) | This is CaO.2Al2O3 with solubility of Fe | 4 | (CA+2)1(AL+3)3(AL+3, FE+3)1(O-2)7 | |
| C1A6 | BaFe12O19 | hP66 | (194, P6_3/mmc) | This is BaO.6Al2O3, BaO.6Fe2O3 and CaO.6Al2O3 with solubility of Fe | 3 | (BA+2, CA+2)1(AL+3, FE+3)12(O-2)19 | |
| C1A8M2 | CaMg2Al16O27 | hP94 | (187, P-6m2) | This is CaO.8Al2O3.2MgO | 4 | (CA+2)1(AL+3)16(MG+2)2(O-2)27 | |
| C2A14M2 | Unknown Structure | This is 2CaO.14Al2O3.2MgO | 4 | (CA+2)2(AL+3)28(MG+2)2(O-2)46 | |||
| C2F | Ca2Fe2O5 | oP36 | (62, Pnma) | This is 2CaO.Fe2O3 with solubility of Al. | 3 | (CA+2)2(AL+3, FE+3)2(O-2)5 | |
| C3A1 | Ca3Al2O6 | cP264 | (205, Pa-3) | This is 3CaO.Al2O3 with solubility of Fe | 3 | (CA+2)3(AL+3, FE+3)2(O-2)6 | |
| C3A2M1 | 3CaO.2Al2O3.MgO | oP72 | (57, Pbcm) | This is 3CaO.2Al2O3.MgO | 4 | (CA+2)3(AL+3)4(MG+2)1(O-2)10 | |
| C3A3F | Unknown Structure | This is 3CaO.3Al2O3.CaF2 | 4 | (AL+3)6(CA+2)4(F-1)2(O-2)12 | |||
| C4WF4 | Ca4Fe9O17 | mS60 | (5, C2) | This is 4CaO.FeO.4Fe2O3. | 4 | (CA+2)4(FE+2)1(FE+3)8(O-2)17 | |
| C4WF8 | Sr2Fe2O5 | oI44 | (74, Imma) | This is 4CaO.FeO.8Fe2O3 | 4 | (CA+2)4(FE+2)1(FE+3)16(O-2)29 | |
| CA10P6O25 | Unknown Structure | This is Ca10(PO4)6O. | 3 | (CA+2)10(PO4-3)6(O-2)1 | |||
| CA10SI3O15F2 | Unknown Structure | This is 9CaO.3SiO2.CaF2 | 4 | (CA+2)10(SI+4)3(O-2)15(F-1)2 | |||
| CA10V6O19 | Unknown Structure | 3 | (CA+2)5(V+3)3(O-2)9.5 | ||||
| CA11B2SI4O22_HT | Unknown Structure | 4 | (CA+2)11(B+3)2(SI+4)4(O-2)22 | ||||
| CA11B2SI4O22_LT | Unknown Structure | 4 | (CA+2)11(B+3)2(SI+4)4(O-2)22 | ||||
| CA15CU18O35 | Ca4.8Cu6O11.6 | mP92 | (13, P2/c) | 4 | (CA+2)15(CU+2)14(CU+3)4(O-2)35 | ||
| CA2AL2B2O8 | Unknown Structure | 4 | (CA+2)2(AL+3)2(B+3)2(O-2)8 | ||||
| CA2ALF7 | Ca2AlF7 | oP40 | (62, Pnma) | 3 | (CA+2)2(AL+3)1(F-1)7 | ||
| CA2ALNBO6 | Ca2AlNbO6 | mP24 | (14, P2_1/c) | 4 | (CA+2)2(AL+3)1(NB+5)1(O-2)6 | ||
| CA2B2O5_S1 | b-Mg2B2O5 | mP36 | (14, P2_1/c) | 3 | (CA+2)2(B+3)2(O-2)5 | ||
| CA2B2O5_S2 | Ca2B2O5 | oP36 | (19, P2_12_12_1) | 3 | (CA+2)2(B+3)2(O-2)5 | ||
| CA2CUO3 | Sr2CuO3 | oI12 | (71, Immm) | 3 | (CA+2)2(CU+2)1(O-2)3 | ||
| CA2GD2ZRO7 | Unknown Structure | 4 | (CA+2)2(GD+3)2(ZR+4)1(O-2)7 | ||||
| CA2HF7O16 | Ca2Hf7O16 | hR25 | (148, R-3) | 3 | (CA+2)2(HF+4)7(O-2)16 | ||
| CA2NA2SI2O7 | Na2Ca2Si2O7 | mS208 | (15, C2/c) | 4 | (CA+2)2(NA+1)2(SI+4)2(O-2)7 | ||
| CA2NA2SI3O9 | Na(Na0.5Ca0.5)2CaSi3O9 | hP102 | (152, P3_121) | 4 | (CA+2)2(NA+1)2(SI+4)3(O-2)9 | ||
| CA2NB2O7 | La2Ti2O7 | mP44 | (4, P2_1) | 3 | (CA+2)2(NB+5)2(O-2)7 | ||
| CA2P2O7_A | Ce2Si2O7 | mP44 | (14, P2_1/c) | This is alpha- Ca2(P2O7). | 2 | (CA+2, MG+2)2(P2O7-4)1 | |
| CA2P2O7_B | beta-Ca2[P2O7] | tP88 | (76, P4_1) | This is beta- Ca2(P2O7). | 2 | (CA+2, MG+2)2(P2O7-4)1 | |
| CA2P2O7_G | Unknown Structure | This is gamma- Ca2(P2O7). | 2 | (CA+2, MG+2)2(P2O7-4)1 | |||
| CA2P6O17 | Ca2P6O17 | mP56 | (14, P2_1/c) | This is Ca2(P2O5)3O2. | 3 | (CA+2)2(P+5)6(O-2)17 | |
| CA2SIO4_ALPHA_A | Ca2SiO4 | hP24 | (194, P6_3/mmc) | This is 2CaO.SiO2 and 3CaO.P2O5. | 3 | (BA+2, CA+2, GD+3, LI2+2, MG+2, MN+2, Y+3)3(CA+2, VA)1(BO3-3, PO4-3, SIO4-4)2 | |
| CA2SIO4_ALPHA_PRIME | K2CoCl4 | oP84 | (33, Pna2_1) | This is Ca2SiO4. | 3 | (BA+2, CA+2, FE+2, GD+3, LI2+2, MG+2, MN+2, Y+3)3(CA+2, VA)1(BO3-3, PO4-3, SIO4-4)2 | |
| CA2V2O7 | Sr2V2O7 | aP | (2, P-1) | 3 | (CA+2)2(V+5)2(O-2)7 | ||
| CA2YB2O5 | Unknown Structure | 3 | (CA+2)2(YB+3)2(O-2)5 | ||||
| CA2ZRSI4O12 | cyclosilicate (Ca2ZrSi4O12) | mP38 | (11, P2_1/m) | 4 | (CA+2)2(SI+4)4(ZR+4)1(O-2)12 | ||
| CA3B2O6 | Ca3[BO3]2 | hR22 | (167, R-3c) | 3 | (CA+2)3(B+3)2(O-2)6 | ||
| CA3CO2O6 | Ca3Co2O6 | hR22 | (167, R-3c) | 3 | (CA+2)3(CO+3, CU+2)2(O-2, VA)6 | ||
| CA3CO4O9 | Ca3Co4O9 | mS30 | (12, C2/m) | 3 | (CA+2)3(CO+3, CU+2)4(O-2, VA)9 | ||
| CA3COAL4O10 | Ca3ZnAl4O10 | oP72 | (29, Pca2_1) | 4 | (CA+2)3(CO+2)1(AL+3)4(O-2)10 | ||
| CA3MG3P4O16 | Unknown Structure | This is Ca3Mg3(PO4)4 solid solution. | 3 | (CA+2, MG+2)3(MG+2)3(PO4-3)4 | |||
| CA3NA2SI6O16 | Na2Ca3Si6O16 | aP54 | (2, P-1) | 4 | (CA+2)3(NA+1)2(SI+4)6(O-2)16 | ||
| CA3NB2O8 | Unknown Structure | 3 | (CA+2)3(NB+5)2(O-2)8 | ||||
| CA3P2O8_A | Ca3[PO4]2 | mP312 | (14, P2_1/c) | This is alpha- Ca3(PO4)2 with solubility of Ba, Mg and Si. | 3 | (BA+2, CA+2, MG+2)3(CA+2, VA)1(PO4-3, SIO4-4)2 | |
| CA3P2O8_B | Ca3[AsO4]2 | hR92 | (161, R3c) | This is beta- Ca3(PO4)2 with solubility of Ba and Mg. | 2 | (BA+2, CA+2, MG+2)3(PO4-3)2 | |
| CA3S3FE4OX | Unknown Structure | This is 3CaS.4FeO and 3CaS.4Fe2O3. | 4 | (CA+2)3(S-2)3(FE+2, FE+3)4(O-2, VA)6 | |||
| CA3TI2O7 | Ca3Ti2O7 | oS48 | (36, Cmc2_1) | 3 | (CA+2)3(TI+4)2(O-2)7 | ||
| CA3TI8AL12O37 | Unknown Structure | 4 | (CA+2)3(TI+4)8(AL+3)12(O-2)37 | ||||
| CA3V2O8 | K2PbS2O8 | hR273 | (161, R3c) | 3 | (CA+2)3(V+5)2(O-2)8 | ||
| CA3WO6 | Cryolite (Na3AlF6, J26) | J26 | mP20 | (14, P2_1/c) | 3 | (CA+2)3(W+6)1(O-2)6 | |
| CA3Y2SI3O12 | Ca3Y2Si3O12 | oP100 | (62, Pnma) | This is 3CaO.(Gd,Y,Yb)2O3.3SiO2. | 4 | (CA+2)3(GD+3, Y+3, YB+3)2(SI+4)3(O-2)12 | |
| CA3Y2SI6O18 | Ca0.6Y0.4Si6O18 | mS116 | (15, C2/c) | This is 3CaO.(Gd,Y,Yb)2O3.6SiO2. | 4 | (CA+2)3(GD+3, Y+3, YB+3)2(SI+4)6(O-2)18 | |
| CA3YB2O6 | Unknown Structure | 3 | (CA+2)3(YB+3)2(O-2)6 | ||||
| CA3ZRSI2O9 | Ca3Hf(Si2O7)O2 | mP60 | (14, P2_1/c) | 4 | (CA+2)3(SI+4)2(ZR+4)1(O-2)9 | ||
| CA4MG2P6O21 | Unknown Structure | 3 | (CA+2)4(MG+2)2(P2O7-4)3 | ||||
| CA4NB2O9_HT11 | Ca4Nb2O9 | mP20 | (14, P2_1/c) | 5 | (CA+2)6(CA+2, NB+5)3(NB+5)3(O-2, VA)3(O-2)15 | ||
| CA4NB2O9_LT21 | Ca4Nb2O9-lt | mP60 | (14, P2_1/c) | 5 | (CA+2)6(CA+2, NB+5)4(CA+2)2(O-2, VA)3(O-2)15 | ||
| CA4P2O9_A | Ca4[PO4]2O | mP60 | (4, P2_1) | This is alpha- Ca4(PO4)2O. | 3 | (CA+2)4(PO4-3)2(O-2)1 | |
| CA4P2O9_B | beta-Ca4(PO4)2O | oP60 | (17, P222_1) | This is beta-Ca4(PO4)2O. | 3 | (CA+2)4(PO4-3)2(O-2)1 | |
| CA4P6O19 | Ca4P6O19 | aP58 | (2, P-1) | This is Ca4(PO3)5(PO4). | 3 | (CA+2)4(PO3-1)5(PO4-3)1 | |
| CA4TI3O10 | Ca4Ti3O10 | oP68 | (61, Pbca) | 3 | (CA+2)4(TI+4)3(O-2)10 | ||
| CA4V2O9 | Ca4V2O9 | oF | (22, F222) | 3 | (CA+2)4(V+5)2(O-2)9 | ||
| CA5BA2B10O22 | Unknown Structure | 4 | (CA+2)5(BA+2)2(B+3)10(O-2)22 | ||||
| CA5P2SIO12 | Unknown Structure | 3 | (CA+2, VA)5(PO4-3)2(SIO4-4, VA)1 | ||||
| CA5SI2O8F2 | Unknown Structure | This is 4CaO.2SiO2.CaF2 | 4 | (CA+2)5(SI+4)2(O-2)8(F-1)2 | |||
| CA6HF19O44 | Ca6Hf19O44 | hR138 | (167, R-3c) | 3 | (CA+2)6(HF+4)19(O-2)44 | ||
| CA6ZR19O44 | Ca6Hf19O44 | hR138 | (167, R-3c) | 3 | (CA+2)6(ZR+4)19(O-2)44 | ||
| CA7P2SI2O16 | Ca7[(Si0.5P0.5)O4]4 | hP180 | (169, P6_1) | 3 | (CA+2)7(PO4-3)2(SIO4-4)2 | ||
| CA9V6O18 | Unknown Structure | 3 | (CA+2)9(V+3)6(O-2)18 | ||||
| CAAL2B2O7 | Unknown Structure | 4 | (CA+2)1(AL+3)2(B+3)2(O-2)7 | ||||
| CAALF5_S1 | CrMnF5 | mS28 | (15, C2/c) | 3 | (CA+2)1(AL+3)1(F-1)5 | ||
| CAALF5_S2 | CrMnF5 | mP28 | (14, P2_1/c) | 3 | (CA+2)1(AL+3)1(F-1)5 | ||
| CAB2O4 | CaB2O4 I (E32) | E32 | oP28 | (60, Pbcn) | 3 | (CA+2)1(B+3)2(O-2)4 | |
| CAB4O7 | CaB4O7 | mP96 | (14, P2_1/c) | 3 | (CA+2)1(B+3)4(O-2)7 | ||
| CABA2B2O6 | Unknown Structure | 4 | (CA+2)1(BA+2)2(B+3)2(O-2)6 | ||||
| CABA2B6O12 | Unknown Structure | 4 | (CA+2)1(BA+2)2(B+3)6(O-2)12 | ||||
| CAC2_BETA | CaC2 | cF36 | (225, Fm-3m) | 2 | (CA+2)1(C2-2)1 | ||
| CAC2_C11A | CaC2-I (C11a) | C11a | tI6 | (139, I4/mmm) | 2 | (CA+2)1(C2-2)1 | |
| CACO3 | Calcite (CaCO3, G01) | G01 | hR30 | (167, R-3c) | This is (Ca,Fe,Mg)CO3. | 2 | (CA+2, FE+2, MG+2)1(CO3-2)1 |
| CACR2O4_A | SrCr2O4 | oP28 | (59, Pmmn) | With solubility of Al and Fe. | 3 | (BA+2, CA+2)1(AL+3, CR+3, FE+3)2(O-2)4 | |
| CACRSI4O10 | gillespite (BaFeSi4O10) | tP64 | (130, P4/ncc) | This is CaO.CrO.4SiO2, Gillespite | 4 | (CA+2)1(CR+2)1(SI+4)4(O-2)10 | |
| CACU2O3 | Shcherbinaite (V2O5) (Revised) | oP14 | (59, Pmmn) | 3 | (CA+2)1(CU+2)2(O-2)3 | ||
| CAF2_S1 | Fluorite (CaF2, C1) | C1 | cF12 | (225, Fm-3m) | This is low temperature CaF2. | 2 | (BA+2, CA+2, MG+2, MN+2)1(F-1, O-2, VA)2 |
| CAF2_S2 | Cotunnite (PbCl2, C23) | C23 | oP12 | (62, Pnma) | This is high temperature CaF2. | 2 | (CA+2, MG+2, MN+2)1(F-1, O-2, VA)2 |
| CAMG3O16S4 | Unknown Structure | This is CaMg3(SO4)4. | 3 | (CA+2)1(MG+2)3(SO4-2)4 | |||
| CAMN2O4 | CaMn2O4 | oP28 | (57, Pbcm) | 3 | (CA+2)1(MN+3)2(O-2)4 | ||
| CAMO3 | CaTiO3 Pnma Perovskite | oP20 | (62, Pnma) | This is CaHfO3, CaMnO3, CaTiO3, lt CaZrO3. | 3 | (CA+2, GD+3, Y+3)1(GD+3, HF+4, MN+4, TI+4, Y+3, ZR+4)1(O-2)3 | |
| CAN2O6 | Pb(NO3)2 (G21) | G21 | cP36 | (205, Pa-3) | This is (Ba, Ca, Mg)(NO3)2 solid solution. | 2 | (BA+2, CA+2, MG+2)1(NO3-1)2 |
| CANA2SI5O12 | Unknown Structure | 4 | (CA+2)1(NA+1)2(SI+4)5(O-2)12 | ||||
| CANA2SIO4 | Na2CaSiO4 (S66) | S66 | cP32 | (198, P2_13) | 4 | (CA+2)1(NA+1)2(SI+4)1(O-2)4 | |
| CANA4SI3O9 | K4SrGe3O9 | cP272 | (205, Pa-3) | 4 | (CA+2)1(NA+1)4(SI+4)3(O-2)9 | ||
| CAP2O6_A | CaP2O6 | mS72 | (9, Cc) | This is alpha-Ca(PO3)2. | 2 | (CA+2)1(PO3-1)2 | |
| CAP2O6_B | PbP2O6 | mP72 | (14, P2_1/c) | This is beta-Ca(PO3)2. | 2 | (CA+2)1(PO3-1)2 | |
| CAP2O6_G | CaP2O6 | mP72 | (9, Cc) | This is gamma-Ca(PO3)2. | 2 | (CA+2)1(PO3-1)2 | |
| CAP4O11_A | CaP4O11 | oS128 | (41, Aea2) | This is alpha- Ca(P2O5)2O. | 3 | (CA+2)1(P+5)4(O-2)11 | |
| CAP4O11_B | CaP4O11 | mP64 | (14, P2_1/c) | This is beta- Ca(P2O5)2O. | 3 | (CA+2)1(P+5)4(O-2)11 | |
| CARNEGIEITE_A | alpha-Carnegieite (NaAlSiO4, S65) | S65 | cP28 | (198, P2_13) | This is NaAlSiO4 with solubility of Fe and Si. | 3 | (NAAL+4, NAFE+4, SI+4)4(SI+4)4(O-2)16 |
| CARNEGIEITE_B | NaAl[SiO4] | oP56 | (29, Pca2_1) | This is NaAlSiO4 with solubility of Fe and Si. | 3 | (NAAL+4, NAFE+4, SI+4)4(SI+4)4(O-2)16 | |
| CASFEO | Unknown Structure | This is CaS.FeO and CaS.Fe2O3. | 4 | (CA+2)2(S-2)2(FE+2, FE+3)2(O-2, VA)3 | |||
| CASO4_HT | CePO4 | hP18 | (180, P6_222) | This is high- temperature (Ca,Co,Mg)SO4. | 2 | (CA+2, CO+2, MG+2)1(SO4-2)1 | |
| CAV2O4 | CaV2O4 | oP28 | (62, Pnma) | This is CaO.Fe2O3, b-CaCr2O4, Ca(V,Y,Yb)2O4, Ba(Gd,La,Y)2O4. | 3 | (BA+2, CA+2)1(AL+3, CR+3, FE+3, GD+3, LA+3, V+3, Y+3, YB+3)2(O-2)4 | |
| CAV2O5 | CaV2O5 | oP16 | (59, Pmmn) | 3 | (CA+2)1(V+4)2(O-2)5 | ||
| CAV2O6 | ThTi2O6 | mS18 | (12, C2/m) | This is CaV2O6, CoV2O6, MgV2O6, MnV2O6 and NiV2O6. | 3 | (CA+2, CO+2, MG+2, MN+2, NI+2)1(V+5)2(O-2)6 | |
| CAV3O7 | CaV3O7 | oP44 | (62, Pnma) | 3 | (CA+2)1(V+4)3(O-2)7 | ||
| CAV4O9 | CaV4O9 | tP9 | (85, P4/n) | 3 | (CA+2)1(V+4)4(O-2)9 | ||
| CAVO3 | Unknown Structure | 3 | (CA+2)1(V+4)1(O-2)3 | ||||
| CAWO4 | Scheelite (CaWO4, H04) | H04 | tI24 | (88, I4_1/a) | 3 | (CA+2)1(W+6)1(O-2)4 | |
| CAY4O7 | (Ca0.25Gd0.75)4GdO7 | mS48 | (12, C2/m) | This is CaY4O7 and CaGd4O7. | 3 | (CA+2)1(GD+3, Y+3)4(O-2)7 | |
| CAYAL3O7 | Akermanite (Ca2MgSi2O7, S53) | S53 | tP24 | (113, P-42_1m) | This is CaYAl3O7, CaYbAl3O7 and CaGdAl3O7 | 4 | (CA+2)1(GD+3, Y+3, YB+3)1(AL+3)3(O-2)7 |
| CAYALO4 | K2NiF4 | tI14 | (139, I4/mmm) | This is CaYAlO4, CaYbAlO4 and CaGdAlO4 | 4 | (CA+2)1(GD+3, Y+3, YB+3)1(AL+3)1(O-2)4 | |
| CAZR4O9 | CaZr4O9 | mS224 | (15, C2/c) | 3 | (CA+2)1(ZR+4)4(O-2)9 | ||
| CAZRO3_C | Cubic Perovskite (CaTiO3, E21) | E21 | cP5 | (221, Pm-3m) | Ba(Hf,Zr)O3 and High-temperature Ca(Hf,Zr)O3. | 3 | (BA+2, CA+2, Y+3)1(HF+4, Y+3, ZR+4)1(O-2)3 |
| CBCC_A12 | alpha-Mn (A12) | A12 | cI58 | (217, I-43m) | 2 | (AL, CO, CR, CU, FE, MG, MN, MO, NB, NI, SI, TI, V, ZR)1(B, C, N, VA)1 | |
| CEMENTITE_D011 | Cementite (Fe3C, D011) | D011 | oP16 | (62, Pnma) | 2 | (AL, CO, CR, FE, MN, MO, NB, NI, SI, V, W)3(B, C, N)1 | |
| CF2 | Ca3.5Fe14O24.5 | mS172 | (5, C2) | This is CaO.2Fe2O3 | 3 | (CA+2)1(FE+3)4(O-2)7 | |
| CHALCOCITE_ALPHA | Cu2S-alpha | mP144 | (14, P2_1/c) | This is Cu2S. | 2 | (CU)2(S)1 | |
| CHALCOCITE_BETA | Cu2S-beta | hP16 | (194, P6_3/mmc) | This is Cu2S. | 2 | (CU)2(S)1 | |
| CHALCOPYRITE | Chalcopyrite (CuFeS2, E11) | E11 | tI16 | (122, I-42d) | This is high-temperature nonstoichiometric CuFeS2. | 3 | (CU, FE, VA)1(CU, VA)1(S)1 |
| CLINO_PYROXENE | Diopside [CaMg(SiO3)2, S41] | S41 | mS40 | (15, C2/c) | This is clino-enstatite (MgSiO3), clino-ferrosilit (FeSiO3), diopside (CaMgSi2O6), niopside (CaNiSi2O6), pigeonite ((Mg,Fe,Ca)Si2O6), hedenbergite (CaFeSi2O6) dissolving Co. | 4 | (CA+2, FE+2, MG+2, NI+2)1(CO+2, FE+2, MG+2, NI+2)1(SI+4)2(O-2)6 |
| CO1LA2O4 | La2CoO4 | oP36 | (55, Pbam) | 3 | (LA+3)2(CO+2)1(O-2)4 | ||
| CO3LA4O10 | Nd4Co3O10 | mP68 | (14, P2_1/c) | 4 | (LA+3)4(CO+2)1(CO+3)2(O-2)10 | ||
| CO3P2O8 | Co3[PO4]2 | mP26 | (14, P2_1/c) | This is (Co,Fe, Mg,Ni)3P2O8 with solubility of Ca. | 2 | (CA+2, CO+2, FE+2, MG+2, NI+2)3(PO4-3)2 | |
| CO9S8 | Co9S8 (D89) | D89 | cF68 | (225, Fm-3m) | 2 | (CO, FE, NI)9(S)8 | |
| COLUMBITE | Columbite (FeNb2O6, E51) | E51 | oP36 | (60, Pbcn) | This is (Ca,Co,Fe,Mg,Mn)Nb2O6 with excess FeO and MgO. | 3 | (CA+2, CO+2, FE+2, MG+2, MN+2)1(FE+2, MG+2, NB+5)2(O-2, VA)6 |
| CORDIERITE | Na0.04(Mg0.5Fe0.5)2Al4Si5O18 | oS120 | (66, Cccm) | This is 2Al2O3.2MgO.5SiO2, 2Al2O3.2MnO.5SiO2 and 2Al2O3.2FeO.5SiO2 | 4 | (AL+3)4(FE+2, MG+2, MN+2)2(SI+4)5(O-2)18 | |
| CORUNDUM | Corundum (Al2O3, D51) | D51 | hR10 | (167, R-3c) | This is Al2O3, Cr2O3, Fe2O3, Ti2O3, V2O3 + (Co,Fe,Mg,Mn,Ni)TiO3 Ilmenite. | 2 | (AL+3, CO+2, CR+3, FE+2, FE+3, MG+2, MN+2, MN+3, NI+2, TI+3, TI+4, V+3, V+4, VA)2(O-2)3 |
| COVELLITE | Covellite (CuS, B18) | B18 | hP12 | (194, P6_3/mmc) | This is CuS. | 2 | (CU)1(S)1 |
| CR1S1 | CrS | mS8 | (15, C2/c) | This is low-temp CrS. | 2 | (CR)1.03(S)1 | |
| CR2P4O13 | Cr2P4O13 | mP76 | (14, P2_1/c) | This is Cr2P4O13, Cr2V4O13 and Fe2V4O13. | 3 | (CR+3, FE+3)2(P+5, V+5)4(O-2)13 | |
| CR2S3 | Dolomite [MgCa(CO3)2, G11] | G11 | hR10 | (148, R-3) | 2 | (CR, FE)2(S)3 | |
| CR2TI2O7 | Unknown Structure | with solubility of Al2O3 and Fe2O3. | 3 | (AL+3, CR+3, FE+3)2(TI+4)2(O-2)7 | |||
| CR3P2O8 | Unknown Structure | 2 | (CR+2)3(PO4-3)2 | ||||
| CR3PO7 | Unknown Structure | 3 | (CR+3)3(P+5)1(O-2)7 | ||||
| CR3S4 | Brezinaite (Cr3S4) | mS14 | (12, C2/m) | 2 | (CR, FE, MN, NI)3(S)4 | ||
| CR4P6O21 | Unknown Structure | 2 | (CR+3)4(P2O7-4)3 | ||||
| CR5PO10 | Unknown Structure | 3 | (CR+3)5(P+5)1(O-2)10 | ||||
| CR5S6 | Cr5S6 | hP22 | (163, P-31c) | 2 | (CR)5(S)6 | ||
| CR7S8 | Cr7Se8 | mS30 | (12, C2/m) | 2 | (CR)7(S)8 | ||
| CRISTOBALITE | Ideal beta-Cristobalite (SiO2, C9) | C9 | cF24 | (227, Fd-3m) | SiO2 with AlPO4 solubility. | 2 | (AL+3, SI+4)1(PO4-3, SIO4-4)1 |
| CRNB25O64 | Unknown Structure | 3 | (CR+3)1(NB+5)25(O-2)64 | ||||
| CRNB49O124 | Unknown Structure | 3 | (CR+3)1(NB+5)49(O-2)124 | ||||
| CRNB9O24 | Unknown Structure | 3 | (CR+3)1(NB+5)9(O-2)24 | ||||
| CRNBO4 | Rutile (TiO2, C4) | C4 | tP6 | (136, P4_2/mnm) | 3 | (CR+3, VA)1(CR+3, NB+5)1(O-2, VA)4 | |
| CRPO4 | Cr[PO4] | oI72 | (74, Imma) | 2 | (CR+3)1(PO4-3)1 | ||
| CRVO4 | MgSO4 | oS24 | (63, Cmcm) | 3 | (CR+3)1(V+5)1(O-2)4 | ||
| CRYOLITE | Cryolite (Na3AlF6, J26) | J26 | mP20 | (14, P2_1/c) | This is (K,Na)3AlF6 solid solution. | 2 | (K+1, LI+1, NA+1, VA)3(ALF4-1, ALF6-3)1 |
| CU2B4O7 | Unknown Structure | 3 | (CU+1)2(B+3)4(O-2)7 | ||||
| CU2COO3 | CaCu2O3 | oP12 | (59, Pmmn) | 3 | (CO+2)1(CU+2)2(O-2)3 | ||
| CU2P2O7 | alpha-Zn2V2O7 | mS44 | (15, C2/c) | 2 | (CU+2)2(P2O7-4)1 | ||
| CU2SO4 | Thenardite [Na2SO4 (V), H17] | H17 | oF56 | (70, Fddd) | 2 | (CU+1)2(SO4-2)1 | |
| CU2SO5 | Cu2[SO4]O | mS32 | (12, C2/m) | 1 | (CU2O5S1)1 | ||
| CU2Y2O5 | Cu2Ho2O5 | oP36 | (33, Pna2_1) | 3 | (CU+2)2(Y+3)2(O-2)5 | ||
| CU3B2O6 | Cu3B2O6 | aP110 | (2, P-1) | 3 | (CU+2)3(B+3)2(O-2)6 | ||
| CU3NB2O8 | Cu3(Ta0.5Nb0.5)2O8 | aP13 | (2, P-1) | 3 | (CU+2)3(NB+5)2(O-2)8 | ||
| CU3P2O8 | Unknown Structure | 2 | (CU+2)3(PO4-3)2 | ||||
| CUB2O4 | CuB2O4 | tI84 | (122, I-42d) | 3 | (CU+2)1(B+3)2(O-2)4 | ||
| CUB8O13 | Unknown Structure | 3 | (CU+2)1(B+3)8(O-2)13 | ||||
| CUB_A13 | beta-Mn (A13) | A13 | cP20 | (213, P4_132) | 2 | (AL, CO, CR, CU, FE, HF, MG, MN, MO, NB, NI, SI, TI, V, ZR)1(B, C, N, VA)1 | |
| CUCRS2 | CuCrS2-b | hR4 | (160, R3m) | 3 | (CU)1(CR)1(S)2 | ||
| CUF1 | Zincblende (ZnS, B3) | B3 | cF8 | (216, F-43m) | 2 | (CU+1)1(F-1)1 | |
| CUF2 | CuF2 | mP6 | (14, P2_1/c) | This is CrF2 and CuF2. | 2 | (CR+2, CU+2)1(F-1)2 | |
| CUFES2_LT | Chalcopyrite (CuFeS2, E11) | E11 | tI16 | (122, I-42d) | This is stoichiometric low- temperature CuFeS2. | 3 | (CU)1(FE)1(S)2 |
| CUGD2O4 | CuNd2O4 | tI14 | (139, I4/mmm) | 3 | (CU+2)1(GD+3)2(O-2)4 | ||
| CULA2O4 | CuLa2O4 | oS28 | (64, Cmce) | With solubility of Co. | 3 | (CO+2, CU+2)1(LA+3)2(O-2)4 | |
| CUNB2O6 | CuNb2O6 | mP36 | (14, P2_1/c) | 3 | (CU+2)1(NB+5)2(O-2)6 | ||
| CUO | Tenorite (CuO, B26) | B26 | mS8 | (15, C2/c) | 2 | (CO+2, CU+2)1(O-2)1 | |
| CUP2O6 | CuP2O6 | mS72 | (15, C2/c) | This is (Co,Cu,Fe,Mg, Mn,Ni)P2O6. | 2 | (CO+2, CU+2, FE+2, MG+2, MN+2, NI+2)1(PO3-1)2 | |
| CUPO3 | Unknown Structure | 2 | (CU+1)1(PO3-1)1 | ||||
| CUPRITE | Cuprite (Cu2O, C3) | C3 | cP6 | (224, Pn-3m) | This is Cu2O with solubility of Na. | 2 | (CU+1, NA+1)2(O-2)1 |
| CUSPIDINE | Ca4[Si2O7]([OH]0.25F0.75)2 | mP60 | (14, P2_1/c) | This is 3CaO.2SiO2.CaF2 | 4 | (CA+2)4(SI+4)2(O-2)7(F-1)2 | |
| CW3F | CaFe5O7 | oS52 | (63, Cmcm) | This is CaO.3FeO.Fe2O3. | 4 | (CA+2)1(FE+2)3(FE+3)2(O-2)7 | |
| CWF | CaFe3O5 | oS36 | (63, Cmcm) | This is CaO.FeO.Fe2O3. | 4 | (CA+2)1(FE+2)1(FE+3)2(O-2)5 | |
| DANBURITE | Danburite (CaB2Si2O8, S63) | S63 | oP52 | (62, Pnma) | 4 | (CA+2)1(B+3)2(SI+4)2(O-2)8 | |
| DELAFOSSITE | Rhombohedral Delafossite (CuFeO2) | hR4 | (166, R-3m) | This is Cu(Al,B,Cr,Fe,La,Mn,Y)O2 | 3 | (CU+1)1(AL+3, B+3, CR+3, FE+3, LA+3, MN+3, Y+3)1(O-2)2 | |
| DHCP | alpha-La (A3') | A3' | hP4 | (194, P6_3/mmc) | 2 | (AL, CA, CU, GD, LA, MG, MN, NI, Y)1(O, VA)0.5 | |
| DIAMOND_FCC_A4 | Diamond (A4) | A4 | cF8 | (227, Fd-3m) | This is Silicon | 2 | (AL, B, C, MN, NA, P, SI)1(O, VA)1 |
| DIGENITE | Cu2Se | cF44 | (225, Fm-3m) | This is Cu2S with solubility of Fe, Mg and Mn. | 3 | (CU, FE, MG, MN, VA)2(CU, VA)1(S)1 | |
| DJURLEITE | Cu31S16 | mP376 | (14, P2_1/c) | This is Cu31S16. | 2 | (CU)1.93(S)1 | |
| DYMN2O5 | HoMn2O5 | oP32 | (55, Pbam) | This is Mn2(Gd, Y)O5. | 4 | (GD+3, Y+3)1(MN+3)1(MN+4)1(O-2)5 | |
| ETA_M5SIN | Fe3W3C (E93) | E93 | cF112 | (227, Fd-3m) | 4 | (CR, MO)3(FE, NI)2(SI)1(N)1 | |
| F6NA2SI1_A | Na2SiF6 | hP27 | (150, P321) | 3 | (NA+1)2(SI+4)1(F-1)6 | ||
| F6NA2SI1_B | K2PtCl6 (J11) | J11 | cF36 | (225, Fm-3m) | 3 | (NA+1)2(SI+4)1(F-1)6 | |
| FCC_A1 | Face-Centered Cubic (Cu, A1, fcc) | A1 | cF4 | (225, Fm-3m) | This is FCC_A1 solid solution and TiO and VO cubic oxides. | 2 | (AL, BA, CA, CO, CR, CU, FE, GD, HF, K, LA, LI, MG, MN, MO, NA, NB, NI, P, S, SI, TI, V, VA, W, Y, YB, ZR)1(B, C, N, O, VA)1 |
| FE18P2O24 | Fe4(Fe0.5P0.5)O6 | oS44 | (65, Cmmm) | 4 | (FE+2)16(FE+3)2(PO4-3)2(O-2)16 | ||
| FE2O12S3 | Fe2[SO4]3 | hR34 | (148, R-3) | This is (Al,Cr, Fe)2(SO4)3 | 2 | (AL+3, CR+3, FE+3)2(SO4-2)3 | |
| FE2P2O7 | Fe2[P2O7] | aP11 | (2, P-1) | 2 | (FE+2)2(P2O7-4)1 | ||
| FE2PO5 | Fe2[PO4]O | mS32 | (15, C2/c) | 4 | (FE+2)1(FE+3)1(PO4-3)1(O-2)1 | ||
| FE3BO5 | Fe3[BO3]O2 | oP36 | (55, Pbam) | 4 | (FE+2)2(FE+3)1(B+3)1(O-2)5 | ||
| FE3BO6 | Norbergite [Mg(F,OH)2 . Mg2SiO4, S07] | S07 | oP40 | (62, Pnma) | 3 | (FE+3)3(B+3)1(O-2)6 | |
| FE3P4O14 | Unknown Structure | 3 | (FE+2)1(FE+3)2(P2O7-4)2 | ||||
| FE3PO7 | Fe3PO7 | hR11 | (160, R3m) | 3 | (FE+3)3(P+5)1(O-2)7 | ||
| FE4N_LP1 | gama-Fe4N (L'10) | L'10 | cP5 | (221, Pm-3m) | 2 | (CO, CR, FE, MN, NI)4(C, N, VA)1 | |
| FE4P6O21 | Fe4[P2O7]3 | mP124 | (14, P2_1/c) | 2 | (FE+3)4(P2O7-4)3 | ||
| FE7P6O24 | Fe7[PO4]6 | aP37 | (2, P-1) | 3 | (FE+2)3(FE+3)4(PO4-3)6 | ||
| FE7P8O28 | Unknown Structure | 3 | (FE+2)5(FE+3)2(P2O7-4)4 | ||||
| FE8SI2C | Mn8Si2C | aP* | (1, P1) | 3 | (FE, MN)8(SI)2(C)1 | ||
| FEAL2S4 | ZnIn2S4 | hR7 | (160, R3m) | 3 | (FE)1(AL)2(S)4 | ||
| FEB4O7 | ZnB4O7 | oS48 | (63, Cmcm) | 3 | (FE+2)1(B+3)4(O-2)7 | ||
| FEBO3 | Calcite (CaCO3, G01) | G01 | hR10 | (167, R-3c) | 3 | (FE+3)1(B+3)1(O-2)3 | |
| FEF3 | FeF3 (D012) | D012 | hR8 | (167, R-3c) | This is (Al,Co,Cr, Fe)F3. | 2 | (AL+3, CO+3, CR+3, FE+3)1(F-1)3 |
| FENB14O36 | Unknown Structure | This is (Co, Fe)Nb14O36 | 3 | (CO+2, FE+2)1(NB+5)14(O-2)36 | |||
| FENB25O64 | Unknown Structure | 3 | (FE+3)1(NB+5)25(O-2)64 | ||||
| FENB36O91 | Unknown Structure | This is (Co, Fe)Nb36O91 | 3 | (CO+2, FE+2)1(NB+5)36(O-2)91 | |||
| FENB49O124 | Unknown Structure | 3 | (FE+3)1(NB+5)49(O-2)124 | ||||
| FENB68O171 | Unknown Structure | This is (Co, Fe)Nb68O171 | 3 | (CO+2, FE+2)1(NB+5)68(O-2)171 | |||
| FENB9O24 | Unknown Structure | 3 | (FE+3)1(NB+5)9(O-2)24 | ||||
| FEV2O6 | Unknown Structure | 3 | (FE+2)1(V+5)2(O-2)6 | ||||
| FEVO4 | Zn[MoO4] | aP36 | (2, P-1) | This is FeVO4 and AlVO4. | 3 | (AL+3, FE+3)1(V+5)1(O-2)4 | |
| FLUORAPATITE | Fluorapatite [Ca5F(PO4)3, H57] | H57 | hP42 | (176, P6_3/m) | 3 | (CA+2)10(PO4-3)6(F-1)2 | |
| FLUORITE | Fluorite (CaF2, C1) | C1 | cF12 | (225, Fm-3m) | This is cubic high temp HfO2 and ZrO2 | 2 | (AL+3, BA+2, CA+2, CR+3, FE+2, GD+3, HF+4, LA+3, MG+2, MN+2, MN+3, NB+5, NI+2, SI+4, TI+4, VA, Y+3, YB+3, ZR, ZR+4)2(O-2, VA)4 |
| GARNET | Orthorhombic Garnet | oF320 | (70, Fddd) | This is Grossular, Uvarovite, Spessartine and Goldmanite Garnets and (Gd, Y,Yb)3(Al,Fe)5O12. | 4 | (CA+2, FE+2, GD+3, LA+3, MG+2, MN+2, Y+3, YB+3)3(AL+3, CR+3, FE+3, MG+2, V+3)2(AL+3, CR+3, FE+3, SI+4)3(O-2)12 | |
| GD2SI2O7 | Ce2Si2O7 | mP44 | (14, P2_1/c) | This is (Gd, La)2Si2O7 | 3 | (GD+3, LA+3)1(GD+3, LA+3)1(SI2O7-6)1 | |
| GD2SIO5 | Gd2SiO5 (RE2SiO5 X1) | mP32 | (14, P2_1/c) | This is (Gd,La)2SiO5 | 4 | (GD+3, LA+3)1(GD+3, LA+3)1(SIO4-4)1(O-2)1 | |
| GDBO3 | GdBO3 | hR30 | (155, R32) | This is (Gd,La)BO3 solid solution. | 3 | (GD+3, LA+3)1(B+3)1(O-2)3 | |
| GDF3 | H3Ho | hP24 | (165, P-3c1) | This is high temp (Gd, Y,Yb)F3. | 2 | (GD+3, Y+3, YB+3)1(F-1)3 | |
| GRAPHITE | Hexagonal Graphite (A9) | A9 | hP4 | (194, P6_3/mmc) | Graphite | 1 | (B, C)1 |
| GUGGENITE | CaCu2O3 | oP12 | (59, Pmmn) | 3 | (MG+2)0.825(CU+2)2.175(O-2)3 | ||
| HALITE | Rock Salt (NaCl, B1) | B1 | cF8 | (225, Fm-3m) | This is BaO, CaO, CoO, FeO, MgO, MnO and NiO | 2 | (AL+3, BA+2, CA+2, CO+2, CO+3, CR+3, CU+2, FE+2, FE+3, GD+3, LIAL1/2+2, MG+2, MN+2, MN+3, NA+1, NI+2, NI+3, TI+4, V+3, VA, Y+3, YB+3, ZR+4)1(O-2)1 |
| HATRURITE | Ca3(SiO4)O-b | hR81 | (160, R3m) | This is 3CaO.SiO2 | 3 | (CA+2, GD+3, VA, Y+3)3(SIO4-4)1(O-2)1 | |
| HCP_A3 | Hexagonal Close Packed (Mg, A3, hcp) | A3 | hP2 | (194, P6_3/mmc) | HCP_A3 also describes hexagonal carbides and nitrades. | 2 | (AL, BA, CA, CO, CR, CU, FE, GD, HF, K, LA, LI, MG, MN, MO, NA, NB, NI, SI, TI, V, W, Y, YB, ZR)1(B, C, N, O, VA)0.5 |
| HEAZLEWOODITE_B1 | Cu1.9S | cF12 | (216, F-43m) | This is non- stoichiometric high temperature Ni3S2. | 2 | (CO, FE, NI, VA)2(S)1 | |
| HEAZLEWOODITE_B2 | Unknown Structure | This is non- stoichiometric high temperature Ni4S3. | 2 | (FE, NI, VA)2(S)1 | |||
| HFW2O8 | Zr[WO4]2 | cP44 | (198, P2_13) | 3 | (HF+4)1(W+6)2(O-2)8 | ||
| K10MG5SI11O32 | Unknown Structure | 4 | (K+1)10(MG+2)5(SI+4)11(O-2)32 | ||||
| K2BA3SI8O20 | Unknown Structure | 4 | (K+1)2(BA+2)3(SI+4)8(O-2)20 | ||||
| K2CA2SI2O7 | K2Ca2[Si2O7] | hP108 | (176, P6_3/m) | 4 | (K+1)2(CA+2)2(SI+4)2(O-2)7 | ||
| K2CA2SI9O21 | Unknown Structure | 4 | (K+1)2(CA+2)2(SI+4)9(O-2)21 | ||||
| K2CA3SI6O16 | Unknown Structure | 4 | (K+1)2(CA+2)3(SI+4)6(O-2)16 | ||||
| K2CA6SI4O15 | K2Ca6Si4O15 | mP54 | (13, P2/c) | 4 | (K+1)2(CA+2)6(SI+4)4(O-2)15 | ||
| K2CASIO4 | Unknown Structure | 4 | (K+1)2(CA+2)1(SI+4)1(O-2)4 | ||||
| K2CO3_S1 | K2[CO3] | mP24 | (14, P2_1/c) | With solubility of Na. | 2 | (K+1, NA+1)2(CO3-2)1 | |
| K2FE2SI6O16 | Unknown Structure | 4 | (K+1)2(FE+3)2(SI+4)6(O-2)16 | ||||
| K2FESI3O8 | Unknown Structure | 4 | (K+1)2(FE+2)1(SI+4)3(O-2)8 | ||||
| K2FESI5O12 | K16Mg8Si40O96 | mP160 | (14, P2_1/c) | 4 | (K+1)2(FE+2)1(SI+4)5(O-2)12 | ||
| K2MG3B2O7 | Unknown Structure | 4 | (K+1)2(MG+2)3(B+3)2(O-2)7 | ||||
| K2MG5SI12O30 | K2Mg5Si12O30 | hP100 | (192, P6/mcc) | 4 | (K+1)2(MG+2)5(SI+4)12(O-2)30 | ||
| K2MGF4 | K2NiF4 | tI14 | (139, I4/mmm) | 3 | (MG+2)1(K+1)2(F-1)4 | ||
| K2MGN4O12 | Unknown Structure | 3 | (K+1)2(MG+2)1(NO3-1)4 | ||||
| K2MGSIO4_HT | Unknown Structure | 2 | (K2MG+4, SI+4)1(SIO4-4)1 | ||||
| K2MGSIO4_LT | Na2Be[SiO4] | oP64 | (29, Pca2_1) | 2 | (K2MG+4, SI+4)1(SIO4-4)1 | ||
| K2S2 | Na2O2 | hP12 | (189, P-62m) | 2 | (K)2(S)2 | ||
| K2S3 | K2S3 | oS20 | (36, Cmc2_1) | 2 | (K)2(S)3 | ||
| K2S4 | Unknown Structure | 2 | (K)2(S)4 | ||||
| K2S5 | Tl2S5 | oP28 | (19, P2_12_12_1) | 2 | (K)2(S)5 | ||
| K2S6 | Unknown Structure | 2 | (K)2(S)6 | ||||
| K2SI4O9_ALPHA | K2Si4O9 | aP30 | (2, P-1) | Low-temp K2Si4O9 | 3 | (K+1)2(SI+4)4(O-2)9 | |
| K2SI4O9_BETA | K2Si4O9 | hP30 | (176, P6_3/m) | High-temp K2Si4O9 | 3 | (K+1)2(SI+4)4(O-2)9 | |
| K2TI3O7 | Unknown Structure | 3 | (K+1)2(TI+4)3(O-2)7 | ||||
| K2TI6O13 | Na2Ti6O13 | mS42 | (12, C2/m) | 3 | (K+1)2(TI+4)6(O-2)13 | ||
| K2TIO3 | Cs2PbO3 | oS24 | (63, Cmcm) | 3 | (K+1)2(TI+4)1(O-2)3 | ||
| K3FCO3 | Unknown Structure | 3 | (K+1)3(F-1)1(CO3-2)1 | ||||
| K3PO4_ALPHA | Unknown Structure | low-temp | 2 | (K+1)3(PO4-3)1 | |||
| K3PO4_BETA | Unknown Structure | mid-temp | 2 | (K+1)3(PO4-3)1 | |||
| K3PO4_GAMMA | K3[PO4]-ht | cF32 | (202, Fm-3) | high-temp | 2 | (K+1)3(PO4-3)1 | |
| K4AL22O35 | K2Al10.67O17 | hR30 | (166, R-3m) | This is Beta double prime-Al2O3 K4(AL,Fe)22O35 solid solution. | 6 | (K+1, VA)1(K+1, VA)1(AL+3, FE+3, MG+2)2(O-2, VA)1(AL+3, FE+3)9(O-2)17 | |
| K4B6O11 | Unknown Structure | 3 | (K+1)4(B+3)6(O-2)11 | ||||
| K4BASI3O9 | K4SrSi3O9 | oS68 | (40, Ama2) | 4 | (K+1)4(BA+2)1(SI+4)3(O-2)9 | ||
| K4CAN6O18 | Unknown Structure | 3 | (K+1)4(CA+2)1(NO3-1)6 | ||||
| K4CASI3O9 | K4SrGe3O9 | cP272 | (205, Pa-3) | 4 | (K+1)4(CA+2)1(SI+4)3(O-2)9 | ||
| K4CASI6O15 | Unknown Structure | 4 | (K+1)4(CA+2)1(SI+4)6(O-2)15 | ||||
| K4FE4SI3O14 | Unknown Structure | 4 | (K+1)4(FE+3)4(SI+4)3(O-2)14 | ||||
| K4FEO3 | Unknown Structure | 3 | (K+1)4(FE+2)1(O-2)3 | ||||
| K4MG2SI5O14 | Unknown Structure | 4 | (K+1)4(MG+2)2(SI+4)5(O-2)14 | ||||
| K4P2O7_ALPHA | K4[P2O7] | hP234 | (169, P6_1) | 2 | (K+1)4(P2O7-4)1 | ||
| K4P2O7_BETA | K4[P2O7] | hP26 | (194, P6_3/mmc) | 2 | (K+1)4(P2O7-4)1 | ||
| K4P2O7_DELTA | Unknown Structure | 2 | (K+1)4(P2O7-4)1 | ||||
| K4P2O7_GAMMA | Unknown Structure | 2 | (K+1)4(P2O7-4)1 | ||||
| K4SIO4 | Cs4SnO4 | mP36 | (14, P2_1/c) | 3 | (K+1)4(SI+4)1(O-2)4 | ||
| K4TIO4 | Unknown Structure | 3 | (K+1)4(TI+4)1(O-2)4 | ||||
| K5B19O31 | K5B19O31 | mS220 | (15, C2/c) | 3 | (K+1)5(B+3)19(O-2)31 | ||
| K5P3O10_ALPHA | Unknown Structure | 3 | (K+1)5(P+5)3(O-2)10 | ||||
| K5P3O10_BETA | Unknown Structure | 3 | (K+1)5(P+5)3(O-2)10 | ||||
| K8BASI10O25 | Unknown Structure | hR* | 4 | (K+1)8(BA+2)1(SI+4)10(O-2)25 | |||
| K8CASI10O25 | Unknown Structure | 4 | (K+1)8(CA+2)1(SI+4)10(O-2)25 | ||||
| K8TI5O14 | Unknown Structure | 3 | (K+1)8(TI+4)5(O-2)14 | ||||
| KAL11O17 | beta-Alumina (Al2O3, D56) | D56 | hP60 | (194, P6_3/mmc) | This is Beta-Al2O3 K(Al,Fe)11O17 solid solution. | 6 | (K+1, VA)1(K+1, VA)1(AL+3, FE+3, MG+2)2(O-2, VA)1(AL+3, FE+3)9(O-2)17 |
| KALSI2O6 | K8(Al0.33Si0.67)24O48 | tI160 | (88, I4_1/a) | This is KAlSi2O6-KFeSi2O6-K2MgSi5O12 solid solution. | 5 | (K+1)2(AL+3, FE+3, MG+2)1(AL+3, FE+3, SI+4)1(SI+4)4(O-2)12 | |
| KALSIO4_HT | KLi[SO4] | hP14 | (159, P31c) | This is high temperature KAlSiO4-K2MgSi3O8 ss. with SiO2 solubility | 4 | (K2MG+4, KAL+4)1(KAL+4, SI+4)1(SI+4)2(O-2)8 | |
| KAPPA_E21 | Cubic Perovskite (CaTiO3, E21) | E21 | cP5 | (221, Pm-3m) | 3 | (AL)1(FE, MN)3(C, VA)1 | |
| KB9O14 | Unknown Structure | 3 | (K+1)1(B+3)9(O-2)14 | ||||
| KBSI2O6 | K(Si0.67B0.33)3O6 | cI160 | (220, I-43d) | Lisitsynite | 4 | (K+1)1(B+3)1(SI+4)2(O-2)6 | |
| KBSI3O8 | Danburite (CaB2Si2O8, S63) | S63 | oP52 | (62, Pnma) | 4 | (K+1)1(B+3)1(SI+4)3(O-2)8 | |
| KCAF3 | Cubic Perovskite (CaTiO3, E21) | E21 | cP5 | (221, Pm-3m) | 3 | (CA+2, MG+2)1(K+1)1(F-1)3 | |
| KFESIO4 | Unknown Structure | 4 | (K+1)2(FE+3)2(SI+4)2(O-2)8 | ||||
| KLICO3 | LiBa[BO3] | mP24 | (14, P2_1/c) | 3 | (K+1)1(LI+1)1(CO3-2)1 | ||
| KLIN2O6 | Unknown Structure | 3 | (K+1)1(LI+1)1(NO3-1)2 | ||||
| KMG2AL15O25 | Unknown Structure | 4 | (K+1)1(MG+2)2(AL+3)15(O-2)25 | ||||
| KNO3_S1 | alpha-Potassium Nitrate (KNO3) I | oP20 | (62, Pnma) | This is lt-KNO3 with solubility of Na. | 2 | (K+1, NA+1)1(NO3-1)1 | |
| KPO3_ALPHA | KPO3 | mP40 | (14, P2_1/c) | 2 | (K+1)1(PO3-1)1 | ||
| KPO3_BETA | alpha-Potassium Nitrate (KNO3) I | oP20 | (62, Pnma) | 2 | (K+1)1(PO3-1)1 | ||
| KPO3_GAMMA | KPO3 | oS32 | (63, Cmcm) | 2 | (K+1)1(PO3-1)1 | ||
| KSI_CARBIDE | Mo6Fe11C5 | mS44 | (12, C2/m) | 2 | (CR, FE, MO, W)3(C)1 | ||
| KYANITE | Kyanite (Al2SiO5, S01) | S01 | aP32 | (2, P-1) | This is Al2O3.SiO2 | 4 | (AL+3)1(AL+3)1(SI+4)1(O-2)5 |
| LA1S2 | CeSe2 | mP12 | (14, P2_1/c) | 2 | (LA)1(S)2 | ||
| LA2CR3O12 | Unknown Structure | 3 | (LA+3)2(CR+6)3(O-2)12 | ||||
| LA2CRO6 | Unknown Structure | 3 | (LA+3)2(CR+6)1(O-2)6 | ||||
| LA2MNO4 | K2NiF4 | tI14 | (139, I4/mmm) | La2(Mn,Ni)O4 with Co solubility. | 3 | (LA+3)2(CO+2, MN+2, NI+2)1(O-2)4 | |
| LA2NB12O33 | Unknown Structure | 3 | (LA+3)2(NB+5)12(O-2)33 | ||||
| LA2S3 | Tongbaite (Cr3C2, D510) | D510 | oP20 | (62, Pnma) | This is (Gd,La)2S3. | 2 | (GD, LA)2(S)3 |
| LA2TI3O9 | Unknown Structure | 3 | (LA+3)2(TI+4)3(O-2)9 | ||||
| LA3BO6 | Unknown Structure | This is (Gd, La)3BO6 solid solution. | 3 | (GD+3, LA+3)3(B+3)1(O-2)6 | |||
| LA3NBO7 | La3NbO7 | oP44 | (62, Pnma) | 3 | (LA+3)3(NB+5)1(O-2)7 | ||
| LA3NI2O7 | Sr3Sn2O7 | oS48 | (63, Cmcm) | 4 | (LA+3)3(CO+2, NI+2)1(NI+3)1(O-2)7 | ||
| LA4NI3O10 | La4Ni3O10 | oS68 | (64, Cmce) | La4Ni3O10 with Co solubility. | 4 | (LA+3)4(NI+2)1(CO+3, NI+3)2(O-2)10 | |
| LA4SI3O12 | Unknown Structure | 2 | (LA+3)4(SIO4-4)3 | ||||
| LA4TI3O12 | La4Ti3O12 | hR19 | (148, R-3) | 3 | (LA+3)4(TI+4)3(O-2)12 | ||
| LA4TI9O24 | Nd4Ti9O24 | oF592 | (70, Fddd) | 3 | (LA+3)4(TI+4)9(O-2)24 | ||
| LAAL11O18 | La0.83Al11.83O19 | hP86 | (194, P6_3/mmc) | 3 | (LA+3)1(AL+3)11(O-2)18 | ||
| LAAP | PrNiO3 | hR10 | (167, R-3c) | This is Rhombohedral Perovskite: La(Al,Co)O3 with solubility of Ca, Cu, Ni, Y | 3 | (CA+2, LA+3, Y+3)1(AL+3, CO+3, CU+2, FE+3, NI+2)1(O-2, VA)3 | |
| LAB3O6 | LaB3O6 | mS40 | (15, C2/c) | This is (Gd,La)B3O6 solid solution. | 3 | (GD+3, LA+3)1(B+3)3(O-2)6 | |
| LAF3 | Cementite (Fe3C, D011) | D011 | oP16 | (62, Pnma) | This is low temp (Gd,La,Y,Yb)F3. | 2 | (GD+3, LA+3, Y+3, YB+3)1(F-1)3 |
| LAFE12O19 | Unknown Structure | 4 | (LA+3)1(FE+2)1(FE+3)11(O-2)19 | ||||
| LANB3O9 | La0.67Nb2O6-b | oS36 | (65, Cmmm) | 3 | (LA+3)1(NB+5)3(O-2)9 | ||
| LANBO4 | LaNbO4 | mS24 | (15, C2/c) | 3 | (LA+3)1(NB+5)1(O-2)4 | ||
| LANIO3 | PrNiO3 | hR10 | (167, R-3c) | This is a rhombohedral perovskite | 3 | (LA+3)1(NI+3)1(O-2)3 | |
| LARNITE | Parawollastonite (CaSiO3, S33(II)) | S33(II) | mP60 | (14, P2_1/c) | This is 2CaO.SiO2 (metastable at 1 atm) | 3 | (CA+2)2(SI+4)1(O-2)4 |
| LAYP | CaTiO3 Pnma Perovskite | oP20 | (62, Pnma) | This is an Orthorhombic Perovskite, La(Y,Yb)O3. | 3 | (LA+3, Y+3, YB+3)1(LA+3, VA, Y+3, YB+3, ZR+4)1(O-2)3 | |
| LI2B4O7 | Li2B4O7 | tI104 | (110, I4_1cd) | 3 | (LI+1)2(B+3)4(O-2)7 | ||
| LI2B8O13 | Unknown Structure | 3 | (LI+1)2(B+3)8(O-2)13 | ||||
| LI2CA2SI2O7 | Li2Ca2[Si2O7] | hP78 | (178, P6_122) | 4 | (LI2+2)1(CA+2)2(SI+4)2(O-2)7 | ||
| LI2CA3SI6O16 | Unknown Structure | 4 | (LI2+2)1(CA+2)3(SI+4)6(O-2)16 | ||||
| LI2CA4SI4O13 | Li2Ca4Si4O13 | aP46 | (2, P-1) | 4 | (LI2+2)1(CA+2)4(SI+4)4(O-2)13 | ||
| LI2CASIO4 | [NH4]Ag2AsS4 | tI16 | (121, I-42m) | 4 | (LI2+2)1(CA+2)1(SI+4)1(O-2)4 | ||
| LI2CO3 | Li2[CO3] | mS24 | (15, C2/c) | 2 | (LI+1)2(CO3-2)1 | ||
| LI2CUO2 | Li2CuO2 | oI10 | (71, Immm) | 3 | (LI+1)2(CU+2)1(O-2)2 | ||
| LI2FE3O5 | Unknown Structure | 4 | (LI+1)2(FE+3)2(FE+2)1(O-2)5 | ||||
| LI2MNO3 | Li2MnO3 | mS24 | (12, C2/m) | 3 | (LI+1)2(MN+4)1(O-2)3 | ||
| LI2O2 | Li2O2 | hP8 | (194, P6_3/mmc) | 2 | (LI+1)2(O2-2)1 | ||
| LI2SI2O5_HT | Unknown Structure | 3 | (LI+1, NA+1)2(SI+4)2(O-2)5 | ||||
| LI2SI2O5_LT | Li2Si2O5 | oS36 | (37, Ccc2) | 3 | (LI+1, NA+1)2(SI+4)2(O-2)5 | ||
| LI2ZRF6 | Rosiaite (PbSb2O6) | hP9 | (162, P-31m) | 3 | (LI+1)2(ZR+4)1(F-1)6 | ||
| LI2ZRO3 | Li2ZrO3 | mS24 | (15, C2/c) | 3 | (LI+1)2(ZR+4)1(O-2)3 | ||
| LI3ALF6_S1 | Li3VF6 | mS120 | (15, C2/c) | 2 | (LI+1)3(ALF6-3)1 | ||
| LI3BO3 | Li3[BO3] | mP28 | (14, P2_1/c) | 3 | (LI+1)6(B+3)2(O-2)6 | ||
| LI3N1 | Li3N | hP4 | (191, P6/mmm) | 2 | (LI)3(N)1 | ||
| LI3NASIO4 | Unknown Structure | 4 | (LI+1)3(NA+1)1(SI+4)1(O-2)4 | ||||
| LI3PO4_A | Enargite (AsCu3S4, H25) | H25 | oP16 | (31, Pmn2_1) | 2 | (LI+1)3(PO4-3)1 | |
| LI3ZR4F19 | Zr4F19 | aP52 | (2, P-1) | P-1 | 3 | (LI+1)3(ZR+4)4(F-1)19 | |
| LI3ZRF7 | Unknown Structure | 3 | (LI+1)3(ZR+4)1(F-1)7 | ||||
| LI4B10O17 | Unknown Structure | 3 | (LI+1)4(B+3)10(O-2)17 | ||||
| LI4B2O5_A | Li4B2O5 | oP88 | (29, Pca2_1) | 3 | (LI+1)4(B+3)2(O-2)5 | ||
| LI4B2O5_B | Li4B2O5 | mS44 | (15, C2/c) | 3 | (LI+1)4(B+3)2(O-2)5 | ||
| LI4P2O7_A | Li4[P2O7] | mP52 | (14, P2_1/c) | 2 | (LI+1)4(P2O7-4)1 | ||
| LI4P2O7_B | Li4[P2O7] | aP26 | (2, P-1) | 2 | (LI+1)4(P2O7-4)1 | ||
| LI4SIO4 | Li4[SiO4] | mP28 | (11, P2_1/m) | 4 | (LI2+2, NA2+2)1(LI2+2, MG+2, NA2+2)1(SI+4)1(O-2)4 | ||
| LI4ZRF8 | Li4TbF8 | oP52 | (62, Pnma) | 3 | (LI+1)4(ZR+4)1(F-1)8 | ||
| LI5ALO4 | Li5AlO4 | oP20 | (59, Pmmn) | 3 | (LI+1)5(AL+3, FE+3)1(O-2)4 | ||
| LI6B4O9 | Li6B4O9 | mP76 | (14, P2_1/c) | 3 | (LI+1)6(B+3)4(O-2)9 | ||
| LI6BA2B4O11 | Unknown Structure | 4 | (LI+1)6(BA+2)2(B+3)4(O-2)11 | ||||
| LI6SI2O7 | Li6[Si2O7] | tP30 | (113, P-42_1m) | 3 | (LI+1)6(SI+4)2(O-2)7 | ||
| LI6ZR2O7 | Li6Zr2O7 | mS60 | (15, C2/c) | 3 | (LI+1)6(ZR+4)2(O-2)7 | ||
| LI8SIO6 | Li8CoO6 | hP30 | (185, P6_3cm) | 3 | (LI+1)8(SI+4)1(O-2)6 | ||
| LI8ZRO6 | Li8SnO6 | hR45 | (148, R-3) | 3 | (LI+1)8(ZR+4)1(O-2)6 | ||
| LIAL5O8 | LiFe5O8 | cP56 | (213, P4_132) | This is low-temp LiAl5O8. | 3 | (LI+1)1(AL+3)5(O-2)8 | |
| LIALO2_A | NaFeO2 | hR12 | (166, R-3m) | This is LiCrO2, LiFeO2 and low-temp LiAlO2. | 2 | (LIAL+4, LICO+4, LICR+4, LIFE+4, SI+4)1(O-2)2 | |
| LIALSI2O6_HT | Li(Al0.33Si0.67)3O6 | tP44 | (92, P4_12_12) | 3 | (LIAL+4, SI+4)1(SI+4)2(O-2)6 | ||
| LIALSI2O6_LT | Diopside [CaMg(SiO3)2, S41] | S41 | mS40 | (15, C2/c) | 3 | (LIAL+4)1(SI+4)2(O-2)6 | |
| LIALSI4O10 | LiAlSi4O10 | mP32 | (13, P2/c) | 3 | (LIAL+4)1(SI+4)4(O-2)10 | ||
| LIALSIO4_HT | LiAl[SiO4] | hP21 | (180, P6_222) | 3 | (LIAL+4, SI+4)1(SI+4)1(O-2)4 | ||
| LIALSIO4_LT | Be2[SiO4] | hR126 | (148, R-3) | 3 | (LIAL+4, SI+4)1(SI+4)1(O-2)4 | ||
| LIB3O5 | LiB3O5 | oP36 | (33, Pna2_1) | 3 | (LI+1)2(B+3)6(O-2)10 | ||
| LIBA2B5O10 | LiBa2B5O10 | mP36 | (11, P2_1/m) | 4 | (LI+1)1(BA+2)2(B+3)5(O-2)10 | ||
| LIBAB9O15 | LiBaB9O15 | hR156 | (167, R-3c) | 4 | (LI+1)1(BA+2)1(B+3)9(O-2)15 | ||
| LIBAF3 | Cubic Perovskite (CaTiO3, E21) | E21 | cP5 | (221, Pm-3m) | 3 | (BA+2)1(LI+1)1(F-1)3 | |
| LIBO2 | LiBO2 | mP16 | (14, P2_1/c) | 3 | (LI+1)2(B+3)2(O-2)4 | ||
| LIMNO2 | NaMnO2 | oP8 | (59, Pmmn) | 3 | (LI+1)1(MN+3)1(O-2)2 | ||
| LINO3 | CaCO3 | hR30 | (167, R-3c) | 2 | (LI+1)1(NO3-1)1 | ||
| LIPO3 | LiPO3 | mP100 | (13, P2/c) | 2 | (LI+1)1(PO3-1)1 | ||
| LIYO2 | LiFeO2 | tI16 | (141, I4_1/amd) | 3 | (LI+1)1(Y+3)1(O-2)2 | ||
| LOWCLINO_PYROXENE | Diopside [CaMg(SiO3)2, S41] | S41 | mS40 | (15, C2/c) | This is low clino-enstatite (MgSiO3) and low clino-diopside (CaMgSi2O6). | 4 | (CA+2, MG+2)1(MG+2)1(SI+4)2(O-2)6 |
| M12C | Fe6W6C | cF104 | (227, Fd-3m) | 3 | (CO)6(W)6(C)1 | ||
| M23C6_D84 | Cr23C6 (D84) | D84 | cF116 | (225, Fm-3m) | 3 | (CO, CR, FE, MN, NI, V)20(CO, CR, FE, MN, MO, NI, V, W)3(B, C)6 | |
| M2O3A | La2O3 (D52) | D52 | hP5 | (164, P-3m1) | A-LA2O3. Also hexagonal A-type structure of Gd2O3. | 3 | (BA+2, CA+2, GD+3, HF+4, LA+3, MG+2, Y+3, YB+3, ZR+4)2(O-2, VA)3(O-2, VA)1 |
| M2O3B | B-Sm2O3 | mS30 | (12, C2/m) | This is monoclinic B-type structure of R2O3 | 3 | (AL+3, CA+2, CO+3, GD+3, HF+4, LA+3, MG+2, Y+3, ZR+4)2(O-2, VA)3(O-2, VA)1 | |
| M2O3C | Bixbyite (Mn2O3, D53) | D53 | cI80 | (206, Ia-3) | This is also cubic Gd2O3, Y2O3 and Yb2O3 | 3 | (AL+3, CA+2, CO+3, CR+3, FE+3, GD+3, HF+4, LA+3, MG+2, MN+3, NI+2, TI+4, Y, Y+3, YB+3, ZR+4)2(O-2, VA)3(O-2, VA)1 |
| M2O3H | La2O3 (D52) | D52 | hP5 | (164, P-3m1) | H-La2O3. This is also hexagonal (Gd,Y,Yb)2O3. | 3 | (BA+2, CA+2, GD+3, HF+4, LA+3, MG+2, MN+3, Y, Y+3, YB+3, ZR+4)2(O-2, VA)3(O-2, VA)1 |
| M2O3X | Nd2O3 | cI26 | (229, Im-3m) | X-LA2O3. This is also HT cubic X-type structure of Gd2O3. | 3 | (BA+2, CA+2, GD+3, HF+4, LA+3, MG+2, Y+3, YB+3, ZR+4)2(O-2, VA)3(O-2, VA)1 | |
| M3C2_D510 | Tongbaite (Cr3C2, D510) | D510 | oP20 | (62, Pnma) | 2 | (CO, CR, MO, V, W)3(C)2 | |
| M4O7 | Ti4O7-a | aP22 | (2, P-1) | This is Ti4O7 and V4O7 with solubility of Al and Mn. | 2 | (AL, MN, TI, V)4(O)7 | |
| M5C2 | Mn5C2 (Fe5C2 Hagg carbide) | mS28 | (15, C2/c) | 2 | (FE, MN, NB, V)5(C, N)2 | ||
| M6C_E93 | Fe3W3C (E93) | E93 | cF112 | (227, Fd-3m) | 4 | (CO, FE, NI)2(MO, NB, W)2(CO, CR, FE, MO, NB, NI, SI, V, W)2(C)1 | |
| M6O11 | Ti6O11 | aP34 | (2, P-1) | This is Ti6O11 and V6O11. | 2 | (TI, V)6(O)11 | |
| M7C3_D101 | C3Cr7 (D101) | D101 | oP40 | (62, Pnma) | 2 | (AL, CO, CR, FE, MN, MO, NB, NI, SI, V, W)7(B, C)3 | |
| M7O13 | Ti7O13 | aP40 | (2, P-1) | This is Ti7O13 and V7O13. | 2 | (TI, V)7(O)13 | |
| M8O15 | Ti8O15 | aP46 | (2, P-1) | This is Ti8O15 and V8O15. | 2 | (TI, V)8(O)15 | |
| MALINKOITE | BaZn[GeO4] | hP42 | (173, P6_3) | NaBSiO4 with SiO2 solubility | 2 | (NAB+4, SI+4)1(SIO4-4)1 | |
| MC_ETA | CMo | hP12 | (194, P6_3/mmc) | 2 | (MO, TI, V, W)1(C, VA)1 | ||
| MC_SHP | Tungsten Carbide (Bh) | Bh | hP2 | (187, P-6m2) | 2 | (MO, W)1(C, N)1 | |
| MELILITE | Akermanite (Ca2MgSi2O7, S53) | S53 | tP24 | (113, P-42_1m) | This is gehlenite, akermanite, Fe-akermanite, bennesherite, Ba2MgSi2O7 and 2CaO.CoO.2SiO2. | 5 | (BA+2, CA+2, NA+1)2(AL+3, CO+2, FE+2, FE+3, MG+2)1(AL+3, SI+4)1(SI+4)1(O-2)7 |
| MERWINITE | Ca3Mg(SiO4)2 | mP56 | (14, P2_1/c) | This is 3CaO.MgO.2SiO2 and 3BaO.MgO.2SiO2. | 4 | (BA+2, CA+2)3(MG+2)1(SI+4)2(O-2)8 | |
| MG2B2O5 | Co2B2O5 | aP18 | (2, P-1) | This is (Co,Fe,Mg, Ni)2B2O5 | 3 | (CO+2, FE+2, MG+2, NI+2)2(B+3)2(O-2)5 | |
| MG2C3 | Mg2C3 | oP10 | (58, Pnnm) | 2 | (MG)2(C)3 | ||
| MG2HF5O12 | UY6O12 | hR19 | (148, R-3) | 3 | (MG+2)2(HF+4)5(O-2)12 | ||
| MG2NA2SI6O15 | Na2Mg2Si6O15 | oS200 | (64, Cmce) | 4 | (MG+2)2(NA+1)2(SI+4)6(O-2)15 | ||
| MG2NB34O87 | Unknown Structure | 3 | (MG+2)2(NB+5)34(O-2)87 | ||||
| MG2P2O7_A | Unknown Structure | This is alpha- Mg2(P2O7). | 2 | (CA+2, MG+2)2(P2O7-4)1 | |||
| MG2P2O7_B | Mg2[P2O7] | mP44 | (14, P2_1/c) | This is beta- Mg2(P2O7) and (Co,Ni)2P2O7. | 2 | (CA+2, CO+2, MG+2, NI+2)2(P2O7-4)1 | |
| MG2V2O7 | Co2[V2O7] | mP44 | (14, P2_1/c) | This is Co2V2O7, Mg2V2O7 and Ni2V2O7. | 3 | (CO+2, MG+2, NI+2)2(V+5)2(O-2)7 | |
| MG3N2_D53 | Bixbyite (Mn2O3, D53) | D53 | cI80 | (206, Ia-3) | 2 | (CA, MG)3(N)2 | |
| MG3V2O8 | Ni3[VO4]2 | oS52 | (64, Cmce) | This is Co3V2O8, Mg3V2O8 and Ni3V2O8. | 3 | (CO+2, MG+2, NI+2)3(V+5)2(O-2)8 | |
| MG5NB4O15 | Ta3N5 | oS32 | (63, Cmcm) | 3 | (MG+2)5(NB+5)4(O-2)15 | ||
| MGB4O7 | CdB4O7 | oP96 | (61, Pbca) | 3 | (MG+2)1(B+3)4(O-2)7 | ||
| MGC2 | MgC2 | tP6 | (136, P4_2/mnm) | 2 | (MG)1(C)2 | ||
| MGF2 | Rutile (TiO2, C4) | C4 | tP6 | (136, P4_2/mnm) | This is (Co,Fe,Mg,Mn,Ni,V)F2. | 2 | (CO+2, FE+2, LI2+2, MG+2, MN+2, NI+2, V+2)1(F-1)2 |
| MGNA2SI4O10 | Unknown Structure | 4 | (MG+2)1(NA+1)2(SI+4)4(O-2)10 | ||||
| MGP4O11 | MgP4O11 | mP64 | (14, P2_1/c) | 3 | (MG+2)1(P+5)4(O-2)11 | ||
| MGWO4_TYPE | Huanzalaite (MgWO4, H06) | H06 | mP12 | (13, P2/c) | This is (Al,Fe)NbO4 and (Co,Fe,Mg,Mn,Ni)WO4. | 3 | (AL+3, CO+2, FE+2, FE+3, MG+2, MN+2, NB+5, NI+2, VA)1(NB+5, W+6)1(O-2)4 |
| MN2B4O9 | Unknown Structure | 3 | (MN+3)2(B+3)4(O-2)9 | ||||
| MN2P2O7 | Thortveitite ([Sc,Y]2Si2O7, S21) | S21 | mS22 | (12, C2/m) | 2 | (MN+2)2(P2O7-4)1 | |
| MN2V2O7 | Thortveitite ([Sc,Y]2Si2O7, S21) | S21 | mS22 | (12, C2/m) | 3 | (MN+2)2(V+5)2(O-2)7 | |
| MN3N2 | Mn3N2 | tI10 | (139, I4/mmm) | 2 | (MN)3(N)2 | ||
| MN3P2O8 | Unknown Structure | 2 | (MN+2)3(PO4-3)2 | ||||
| MN4NB2O9 | Nb2Mn4O9 | hP30 | (165, P-3c1) | This is (Co,Fe, Mg,Mn)4Nb2O9. | 3 | (CO+2, FE+2, MG+2, MN+2)4(NB+5)2(O-2)9 | |
| MN5SIC | Mn5SiC | oS56 | (36, Cmc2_1) | 3 | (MN)0.714(SI)0.143(C)0.143 | ||
| MN6N5 | CoO | tI4 | (139, I4/mmm) | 2 | (MN)6(N)5 | ||
| MN9SI3O14S1 | Unknown Structure | This is 8MnO.3SiO2.MnS | 4 | (MN+2)9(SI+4)3(O-2)14(S-2)1 | |||
| MNB2O4 | Unknown Structure | 3 | (MN+2)1(B+3)2(O-2)4 | ||||
| MNB3O6 | Unknown Structure | 3 | (MN+3)1(B+3)3(O-2)6 | ||||
| MNB4O7 | Unknown Structure | 3 | (MN+2)1(B+3)4(O-2)7 | ||||
| MNB6O10 | Unknown Structure | 3 | (MN+2)1(B+3)6(O-2)10 | ||||
| MNBO3 | Unknown Structure | 3 | (MN+3)1(B+3)1(O-2)3 | ||||
| MNF2_S1 | Unknown Structure | 2 | (MN+2)1(F-1)2 | ||||
| MNF3 | MnF3 | mS48 | (15, C2/c) | 2 | (MN+3)1(F-1)3 | ||
| MNYO3_HEX | LuMnO3 | hP30 | (185, P6_3cm) | 3 | (Y+3)1(MN+3)1(O-2)3 | ||
| MO1S2 | Molybdenite (MoS2, C7) | C7 | hP6 | (194, P6_3/mmc) | This is MoS2 and WS2. | 2 | (MO, W)1(S)2 |
| MO2S3 | Mo2S3 | mP10 | (11, P2_1/m) | 2 | (MO)2(S)3 | ||
| MO4O11 | Mo4O11 | oP60 | (33, Pna2_1) | 3 | (MO+4)1(MO+6)3(O-2)11 | ||
| MO8O23 | High-Temperature Mo8O23 | mP62 | (13, P2/c) | 3 | (MO+4)1(MO+6)7(O-2)23 | ||
| MO9O26 | Mo9O26 | mP70 | (13, P2/c) | 3 | (MO+4)1(MO+6)8(O-2)26 | ||
| MOF4 | Unknown Structure | 2 | (MO+4)1(F-1)4 | ||||
| MONOCLINIC_S | beta-S | mP48 | (14, P2_1/c) | 1 | (S)1 | ||
| MOO3 | gamma-WO3 | mP32 | (14, P2_1/c) | 2 | (MO+6)1(O-2)3 | ||
| MULLITE | Al(Al0.7Si0.3)2O4.8 | oP24 | (55, Pbam) | With solubility of B, Cr and Fe. | 4 | (AL+3)1(AL+3, CR+3, FE+3)1(AL+3, B+3, SI+4)1(O-2, VA)5 | |
| NA10SIO7 | Unknown Structure | 3 | (NA+1)10(SI+4)1(O-2)7 | ||||
| NA2AL12O19 | Na0.5Al3O4.75 | oP24 | (55, Pbam) | This is Beta double prime-Al2O3 Na2Al12O19 with solubility of Fe. | 3 | (NA+1)2(AL+3, FE+3)12(O-2)19 | |
| NA2AL2B2O7 | Na2Ga2[BO3]2O | hP30 | (163, P-31c) | 4 | (NA+1)2(AL+3)2(B+3)2(O-2)7 | ||
| NA2B4O7 | Na2B4O7 | aP52 | (2, P-1) | This is (K, Na)2B4O7. | 3 | (K+1, NA+1)2(B+3)4(O-2)7 | |
| NA2B8O13 | Na2B8O13 | mP92 | (14, P2_1/c) | 3 | (NA+1)2(B+3)8(O-2)13 | ||
| NA2BA2SI2O7 | Unknown Structure | 4 | (NA+1)2(BA+2)2(SI+4)2(O-2)7 | ||||
| NA2BA4SI10O25 | Unknown Structure | 4 | (NA+1)2(BA+2)4(SI+4)10(O-2)25 | ||||
| NA2BASI2O6 | Na2BaSi2O6 | mP22 | (4, P2_1) | 4 | (NA+1)2(BA+2)1(SI+4)2(O-2)6 | ||
| NA2CA3AL16O28 | Unknown Structure | 4 | (NA+1)2(CA+2)3(AL+3)16(O-2)28 | ||||
| NA2CA8AL6O18 | Unknown Structure | 4 | (NA+1)2(CA+2)8(AL+3)6(O-2)18 | ||||
| NA2CAAL4O8 | Unknown Structure | This is (K, Na)2CaAl4O8 solid solution. | 4 | (K+1, NA+1, VA)1(CA+2, K+1, NA+1)1(AL+3)2(O-2)4 | |||
| NA2CO3_S1 | Na2[CO3]-b | mS24 | (12, C2/m) | With solubility of K. | 2 | (K+1, NA+1)2(CO3-2)1 | |
| NA2CO3_S2 | Na2[CO3] | hP12 | (194, P6_3/mmc) | This is (K, Na)2CO3 solid solution. | 2 | (K+1, LI+1, NA+1)2(CO3-2, S-2)1 | |
| NA2FEO2 | Unknown Structure | 3 | (NA+1)2(FE+2)1(O-2)2 | ||||
| NA2FESIO4 | Unknown Structure | 4 | (NA+1)2(FE+2)1(SI+4)1(O-2)4 | ||||
| NA2O1_S1 | Fluorite (CaF2, C1) | C1 | cF12 | (225, Fm-3m) | This is rt (K,Li,Na)2O. | 2 | (K+1, LI+1, NA+1)2(O-2)1 |
| NA2O1_S2 | Unknown Structure | This is ht1 (K, Na)2O. | 2 | (K+1, NA+1)2(O-2)1 | |||
| NA2O1_S3 | Unknown Structure | This is ht2 (K, Na)2O. | 2 | (K+1, NA+1)2(O-2)1 | |||
| NA2S1 | Fluorite (CaF2, C1) | C1 | cF12 | (225, Fm-3m) | This is (K,Li,Na)2S. | 2 | (K, LI, NA)2(S)1 |
| NA2SI2O5_ALPHA | Na2Si2O5-a | mP36 | (14, P2_1/c) | This is lt-(K, Na)2Si2O5 solid solution. | 3 | (K+1, LI+1, NA+1)2(SI+4)2(O-2)5 | |
| NA2SI2O5_BETA | Na2Si2O5-b | mP36 | (14, P2_1/c) | This is intermediat-temp (K,Na)2Si2O5 solid solution. | 3 | (K+1, LI+1, NA+1)2(SI+4)2(O-2)5 | |
| NA2SI2O5_GAMMA | Na2Si2O5 | oP36 | (60, Pbcn) | This is ht-(K, Na)2Si2O5 solid solution. | 3 | (K+1, LI+1, NA+1)2(SI+4)2(O-2)5 | |
| NA2SIO3 | Na2SiO3 | oS24 | (36, Cmc2_1) | This is (K, Li, Na)2SiO3 solid solution. | 3 | (K+1, LI+1, NA+1)2(SI+4)1(O-2)3 | |
| NA2TI3O7 | Na2Ti3O7 | mP24 | (11, P2_1/m) | 3 | (NA+1)2(TI+4)3(O-2)7 | ||
| NA2TI6O13 | Na2Ti6O13 | mS42 | (12, C2/m) | 3 | (NA+1)2(TI+4)6(O-2)13 | ||
| NA2TIO3_S1 | Na2TiO3 | mS24 | (12, C2/m) | 3 | (NA+1)2(TI+4)1(O-2)3 | ||
| NA2TIO3_S2 | Rock Salt (NaCl, B1) | B1 | cF8 | (225, Fm-3m) | 3 | (NA+1)2(TI+4)1(O-2)3 | |
| NA2V2O6 | LiVO3 | mS40 | (9, Cc) | 3 | (NA+1)2(V+5)2(O-2)6 | ||
| NA3ALF6_S1 | Cryolite (Na3AlF6, J26) | J26 | mP20 | (14, P2_1/c) | 3 | (NA+1)3(AL+3)1(F-1)6 | |
| NA3BO3 | NaB3O5-a | mP108 | (14, P2_1/c) | This is (K, Na)3BO3. | 3 | (K+1, NA+1)3(B+3)1(O-2)3 | |
| NA3FE5O9 | Na3Fe5O9 | mS68 | (15, C2/c) | 3 | (NA+1)3(FE+3)5(O-2)9 | ||
| NA3FEO3 | Na3FeO3 | mP28 | (14, P2_1/c) | 3 | (NA+1)3(FE+3)1(O-2)3 | ||
| NA3PO4 | Na3[PO4] | cF988 | (225, Fm-3m) | This is Na3(PO4, VO4) | 2 | (NA+1)3(PO4-3, VO4-3)1 | |
| NA4B2O5 | Na4B2O5 | mS44 | (15, C2/c) | This is (K, Na)4B2O5. | 3 | (K+1, NA+1)4(B+3)2(O-2)5 | |
| NA4FE6O11 | Unknown Structure | 3 | (NA+1)4(FE+3)6(O-2)11 | ||||
| NA4FEO3 | Na4FeO3 | mS32 | (9, Cc) | 3 | (NA+1)4(FE+2)1(O-2)3 | ||
| NA4P2O7 | Na4[P2O7] | oP52 | (19, P2_12_12_1) | 2 | (NA+1)4(P2O7-4)1 | ||
| NA4SIO4 | K4SnO4 | aP18 | (2, P-1) | 4 | (LI2+2, NA2+2)1(LI2+2, NA2+2)1(SI+4)1(O-2)4 | ||
| NA4TIO4 | K4SnO4 | aP18 | (2, P-1) | 3 | (NA+1)4(TI+4)1(O-2)4 | ||
| NA4V2O7 | Na4[V2O7] | mS208 | (15, C2/c) | 3 | (NA+1)4(V+5)2(O-2)7 | ||
| NA5AL3F14 | Chiolite (Na5Al3F14, K75) | K75 | tP44 | (128, P4/mnc) | 3 | (NA+1)5(AL+3)3(F-1)14 | |
| NA5FEO4 | Na5GaO4 | oP80 | (61, Pbca) | 3 | (NA+1)5(FE+3)1(O-2)4 | ||
| NA5FESI4O12 | Unknown Structure | 4 | (NA+1)5(FE+3)1(SI+4)4(O-2)12 | ||||
| NA6SI2O7 | Na6[Si2O7] | aP120 | (2, P-1) | 3 | (NA+1)6(SI+4)2(O-2)7 | ||
| NA6SI8O19 | Na6Si8O19 | mP132 | (14, P2_1/c) | 3 | (LI+1, NA+1)6(SI+4)8(O-2)19 | ||
| NA8FE2O7 | Na8Ga2O7 | mP68 | (14, P2_1/c) | 3 | (NA+1)8(FE+3)2(O-2)7 | ||
| NA8FE6SI15O40 | Unknown Structure | 4 | (NA+1)8(FE+2)6(SI+4)15(O-2)40 | ||||
| NA8TI5O14 | Na8Ti5O14 | aP54 | (2, P-1) | 3 | (NA+1)8(TI+4)5(O-2)14 | ||
| NAAL11O17 | NaAl11O17 | hP58 | (194, P6_3/mmc) | This is Beta-Al2O3 (Li,Na)Al11O17 solid solution. | 5 | (LI+1, NA+1)2(NA+1, VA)2(AL+3)22(O-2)34(O-2, VA)1 | |
| NAALO2_D | LiGaO2 | oP16 | (33, Pna2_1) | 2 | (NAAL+4, SI+4)1(O-2)2 | ||
| NAB3O5 | NaB3O5-a | mP108 | (14, P2_1/c) | This is (K, Na)B3O5. | 3 | (K+1, NA+1)1(B+3)3(O-2)5 | |
| NAB5O8_A | Unknown Structure | 3 | (NA+1)1(B+3)5(O-2)8 | ||||
| NAB5O8_B | Unknown Structure | 3 | (NA+1)1(B+3)5(O-2)8 | ||||
| NAB5O8_G | KB5O8-a | oP112 | (61, Pbca) | This is ht-NaB5O8 and KB5O8. | 3 | (K+1, NA+1)1(B+3)5(O-2)8 | |
| NAB9O14_A | Unknown Structure | 3 | (NA+1)1(B+3)9(O-2)14 | ||||
| NAB9O14_B | Unknown Structure | 3 | (NA+1)1(B+3)9(O-2)14 | ||||
| NAB9O14_G | Unknown Structure | 3 | (NA+1)1(B+3)9(O-2)14 | ||||
| NABO2_A | KBO2 (F513) | F513 | hR24 | (167, R-3c) | This is ht-NaBO2 and KBO2. | 3 | (K+1, NA+1)1(B+3)1(O-2)2 |
| NABO2_B | Unknown Structure | rt-NaBO2 | 3 | (NA+1)1(B+3)1(O-2)2 | |||
| NAF1 | Rock Salt (NaCl, B1) | B1 | cF8 | (225, Fm-3m) | This is (K,Li,Na)F. | 2 | (K+1, LI+1, MG+2, NA+1, VA)1(F-1)1 |
| NAFE2O3 | NaFe2O3 | hP6 | (164, P-3m1) | 4 | (NA+1)1(FE+2)1(FE+3)1(O-2)3 | ||
| NAFEO2_A | Caswellsilverite (CrNaS2, F51) | F51 | hR4 | (166, R-3m) | This is also NaCrO2. | 3 | (NA+1)1(CR+3, FE+3)1(O-2)2 |
| NAFEO2_B | LiGaO2 | oP16 | (33, Pna2_1) | This is low-temp K(Al,Fe)O2 + NaAlO2 and mid-temp NaFeO2 solid solutions. | 2 | (KAL+4, KFE+4, NAAL+4, NAFE+4, SI+4)1(O-2)2 | |
| NAFEO2_G | LiAlO2 | tP16 | (92, P4_12_12) | This is high-temp K(Al,Fe)O2, LiAlO2 + NaFeO2 and mid-temp NaAlO2 solid solutions. | 2 | (KAL+4, KFE+4, LIAL+4, NAAL+4, NAFE+4, SI+4)1(O-2)2 | |
| NAFESI2O6 | Diopside [CaMg(SiO3)2, S41] | S41 | mS40 | (15, C2/c) | 4 | (NA+1)1(FE+3)1(SI+4)2(O-2)6 | |
| NAMGF3 | CaTiO3 Pnma Perovskite | oP20 | (62, Pnma) | 3 | (NA+1)1(MG+2)1(F-1)3 | ||
| NANO3_S1 | Calcite (CaCO3, G01) | G01 | hR10 | (167, R-3c) | With solubility of K. | 2 | (K+1, NA+1)1(NO3-1)1 |
| NANO3_S2 | Rb[NO3] | hR9 | (166, R-3m) | This is ht-(K, Na)(NO3) solid solution. | 2 | (K+1, NA+1)1(NO3-1)1 | |
| NAPO3 | NaAsO3 | aP30 | (2, P-1) | 2 | (NA+1)1(PO3-1)1 | ||
| NAS2 | NaS2 | tI48 | (122, I-42d) | 2 | (NA)1(S)2 | ||
| NB2O5 | Nb2O5 | mP99 | (10, P2/m) | 2 | (MG+2, NB+5, V+5, ZR+4)2(O-2, VA)5 | ||
| NB3BO9 | Unknown Structure | 3 | (NB+5)3(B+3)1(O-2)9 | ||||
| NBF5 | MoF5 | mS48 | (12, C2/m) | 2 | (NB+5)1(F-1)5 | ||
| NBO1 | NbO | cP6 | (221, Pm-3m) | 2 | (NB+2)1(O-2)1 | ||
| NBO2 | alpha-NbO2 | tI96 | (88, I4_1/a) | This is NbO2 | 2 | (FE+2, NB+4, NB+5)1(O-2)2 | |
| NEPHELINE_A | Unknown Structure | This is NaAlSiO4 with solubility of Si. | 4 | (NAAL+4)4(NAAL+4, SI+4)4(SI+4)8(O-2)32 | |||
| NEPHELINE_B | Unknown Structure | This is NaAlSiO4 with solubility of Si. | 4 | (NAAL+4)4(NAAL+4, SI+4)4(SI+4)8(O-2)32 | |||
| NEPHELINE_G | KLi[SO4] | hP18 | (173, P6_3) | This is low temperature NaAlSiO4-KAlSiO4, K2MgSi3O8 dissolving SiO2, Fe. | 4 | (K2MG+4, KAL+4, NAAL+4)4(KAL+4, NAAL+4, NAFE+4, SI+4)4(SI+4)8(O-2)32 | |
| NI3B2O6 | Kotoite (Mg3(BO3)2) | oP22 | (58, Pnnm) | This is (Co,Mg,Ni)3B2O6 | 3 | (CO+2, MG+2, NI+2)3(B+3)2(O-2)6 | |
| NI3S2_LT | Hazelwoodite (Ni3S2, D5e) | D5e | hR5 | (155, R32) | 2 | (NI)3(S)2 | |
| NI4NB2O9 | Nb2Ni4O9 | oF480 | (43, Fdd2) | 3 | (NI+2)4(NB+5)2(O-2)9 | ||
| NI6MNO8_TYPE | Mg6MnO8 | cF60 | (225, Fm-3m) | This is (Mg, Ni)6MnO8, with an ordered NaCl-type structure. | 3 | (MG+2, NI+2)6(MN+4)1(O-2)8 | |
| NI7S6 | Unknown Structure | t** | 2 | (FE, NI)7(S)6 | |||
| NI9S8 | Ni9S8 | oS68 | (21, C222) | 2 | (FE, NI)9(S)8 | ||
| NIMNO3 | Ilmenite (FeTiO3, E22) | E22 | hR10 | (148, R-3) | This is NiMnO3 with Ilmenite structure | 2 | (MN+3, MN+4, NI+2)2(O-2)3 |
| NINB14O36 | Unknown Structure | 3 | (NI+2)1(NB+5)14(O-2)36 | ||||
| NINB2O6 | Columbite (FeNb2O6, E51) | E51 | oP36 | (60, Pbcn) | 3 | (NB+5, NI+2, VA)1(NB+5, NI+2)2(O-2, VA)6 | |
| NINB36O91 | Unknown Structure | 3 | (NI+2)1(NB+5)36(O-2)91 | ||||
| NINB68O171 | Unknown Structure | 3 | (NI+2)1(NB+5)68(O-2)171 | ||||
| NIOCALITE_C10NS6 | Niocalite | oS114 | (21, C222) | This is 10CaO.Nb2O5.6SiO2. | 4 | (CA+2)10(NB+5)2(SI+4)6(O-2)27 | |
| NIS_LT | Millerite (NiS, B13) | B13 | hR6 | (160, R3m) | This is low temperature NiS. | 2 | (NI)1(S)1 |
| OKAYAMALITE | Akermanite (Ca2MgSi2O7, S53) | S53 | tP24 | (113, P-42_1m) | 4 | (CA+2)2(B+3)2(SI+4)1(O-2)7 | |
| OLIVINE | Forsterite (Mg2SiO4, S12) | S12 | oP28 | (62, Pnma) | This is Calcio-olivine (Ca2SiO4) - Co2SiO4 - Fayalite (Fe2SiO4) - Forsterite (Mg2SiO4) - Tephroite (Mn2SiO4) - Ni2SiO4 - Kirschsteinite (CaFeSiO4) - Monticellite (CaMgSiO4) solid solution dissolving Cr and Cu. | 4 | (CA+2, CO+2, CR+2, CU+2, FE+2, LI2+2, MG+2, MN+2, NI+2)1(CA+2, CO+2, CR+2, CU+2, FE+2, LI2+2, MG+2, MN+2, NI+2)1(SI+4)1(O-2)4 |
| ORTHORHOMBIC_S | alpha-S (A16) | A16 | oF128 | (70, Fddd) | 1 | (S)1 | |
| ORTHO_PYROXENE | Enstatite (MgSiO3, S43) | S43 | oP80 | (61, Pbca) | This is enstatite (MgSiO3) and ortho-diopside (CaMgSi2O6) with Fe solubility. | 4 | (CA+2, FE+2, MG+2)1(FE+2, MG+2)1(SI+4)2(O-2)6 |
| P2O5_H | P2O5 | hR28 | (161, R3c) | 2 | (P+5)2(O-2)5 | ||
| P2O5_OO | P2O5 | oP56 | (43, Fdd2) | 2 | (P+5)2(O-2)5 | ||
| P2O5_OP | P2O5 | oP28 | (62, Pnma) | 2 | (P+5)2(O-2)5 | ||
| P2S5 | P2S5 | aP28 | (2, P-1) | 2 | (P)2(S)5 | ||
| PENTLANDITE | Co9S8 (D89) | D89 | cF68 | (225, Fm-3m) | 3 | (FE, NI)8(FE, NI)1(S)8 | |
| PEROVSKITE | PrNiO3 | hR10 | (167, R-3c) | This is (Cr,Fe, Mn)LaO3. Also includes (Cr,Fe,Mn)LaO3 O-Perovskite. | 3 | (LA+3, MN+3, VA)1(CO+3, CR+3, CR+4, FE+2, FE+3, FE+4, MN+2, MN+3, MN+4, VA)1(O-2, VA)3 | |
| PI_A13 | beta-Mn (A13) | A13 | cP20 | (213, P4_132) | 3 | (CR)12.8(FE, NI, SI)7.2(N)4 | |
| PROTO_PYROXENE | MgSiO3 | oP40 | (60, Pbcn) | This is proto- enstatite (MgSiO3) and proto-diopside (CaMgSi2O6) dissolving Co, Cr, and Fe. | 3 | (CA+2, CO+2, CR+2, FE+2, MG+2, NI+2)1(SI+4)1(O-2)3 | |
| PSEUDO_BROOKITE | Pseudobrookite (Fe2TiO5, E41) | E41 | oS32 | (63, Cmcm) | This is Fe2TiO5, Ti3O5, Al2TiO5 and (Co,Fe,Mg,Mn)Ti2O5. | 3 | (AL+3, CO+2, FE+2, FE+3, MG+2, MN+2, NI+2, SI+4, TI+3, TI+4, V+3)1(AL+3, FE+3, SI+4, TI+3, TI+4)2(O-2)5 |
| PSEUDO_WOLLASTONITE | CaSiO3 | mS120 | (15, C2/c) | This is CaO.SiO2 with Ba solubility | 3 | (BA+2, CA+2)1(SI+4)1(O-2)3 | |
| PYRITE | Pyrite (FeS2, C2) | C2 | cP12 | (205, Pa-3) | This is Cattierite (CoS2), Pyrite (FeS2) - Hauerite (MnS2) - Vaesite (NiS2). | 2 | (CO, FE, MN, NI)1(S)2 |
| PYROCHLORE | Cubic Pyrochlore (Eu2Ir2O7, E81) | E81 | cF88 | (227, Fd-3m) | This is (Gd,La)2(Hf,Zr)2O7 and (Gd,La,Y,Yb)2Ti2O7. | 5 | (GD+3, HF+4, LA+3, TI+4, Y+3, YB+3, ZR+4)2(GD+3, HF+4, LA+3, TI+4, Y+3, YB+3, ZR+4)2(O-2, VA)6(O-2)1(O-2, VA)1 |
| PYRRHOTITE | NiAs (B81) | B81 | hP4 | (194, P6_3/mmc) | This is (Co,Cr, Fe,Nb,Ni,Ti,V)S. | 2 | (AL, CO, CR, CU, FE, GD, MG, MN, NB, NI, TI, V, VA, ZR)1(S)1 |
| QUARTZ | alpha-Quartz (low Quartz) | hP9 | (152, P3_121) | SiO2 with AlPO4 solubility. | 2 | (AL+3, SI+4)1(PO4-3, SIO4-4)1 | |
| Q_ALMGZRO | Unknown Structure | 4 | (MG+2)4.68(AL+3)2.64(ZR+4)1.68(O-2)12 | ||||
| RANKINITE | 3CaO.2SiO2 | mP48 | (14, P2_1/c) | 3 | (CA+2)3(SI+4)2(O-2)7 | ||
| RED_P | Unknown Structure | This is pure phosphorus. | 1 | (P)1 | |||
| RHODONITE | Rhodonite (MnSiO3-b) | aP50 | (2, P-1) | This is MnO.SiO2 | 3 | (CA+2, CO+2, FE+2, MG+2, MN+2)1(SI+4)1(O-2)3 | |
| RUTILE | Rutile (TiO2, C4) | C4 | tP6 | (136, P4_2/mnm) | This is MnO2, TiO2 and ht-VO2. | 2 | (AL+3, HF+4, MN+4, TI+3, TI+4, V+4, ZR+4)1(O-2, VA)2 |
| SAPPHIRINE | CaMg3Si3O10 | aP68 | (2, P-1) | This is 9Al2O3.7MgO.3SiO2 | 4 | (AL+3)18(MG+2)7(SI+4)3(O-2)40 | |
| SI3N4 | Nierite (alpha-Si3N4) | hP28 | (159, P31c) | 2 | (SI)3(N)4 | ||
| SI3P4O16 | Unknown Structure | 2 | (SI+4)3(PO4-3)4 | ||||
| SIC_B3 | Zincblende (ZnS, B3) | B3 | cF8 | (216, F-43m) | 2 | (SI)1(C)1 | |
| SILLIMANITE | Sillimanite (Al2SiO5, S03) | S03 | oP32 | (62, Pnma) | This is a high-pressure phase | 4 | (AL+3)1(AL+3)1(SI+4)1(O-2)5 |
| SIP2O7_CUB | Si[P2O7] | cP1080 | (205, Pa-3) | This is cubic (Si, Ti)P2O7. | 2 | (SI+4, TI+4)1(P2O7-4)1 | |
| SIP2O7_MONO | Si[P2O7]-a | mP40 | (14, P2_1/c) | 2 | (SI+4)1(P2O7-4)1 | ||
| SIP2O7_TETR | Unknown Structure | 2 | (SI+4)1(P2O7-4)1 | ||||
| SIS2 | SiS2 (C42) | C42 | oI12 | (72, Ibam) | 2 | (SI)1(S)2 | |
| SPHENE | CaTi[SiO4]O | mP32 | (14, P2_1/c) | 4 | (CA+2)1(TI+4)1(SI+4)1(O-2)5 | ||
| SPINEL | Spinel (Al2MgO4, H11) | H11 | cF56 | (227, Fd-3m) | This is MgAl2O4, Fe3O4, Mn3O4 (ht) and many more. | 4 | (AL+3, CO+2, CO+3, CR+2, CR+3, CU+2, FE+2, FE+3, LI+1, MG+2, MN+2, NI+2)1(AL+3, CA+2, CO+2, CO+3, CR+3, CU+2, FE+2, FE+3, LI+1, MG+2, MN+2, MN+3, MN+4, MO+4, NA+1, NI+2, TI+3, TI+4, V+3, VA)2(CR+2, FE+2, MG+2, MN+2, VA)2(O-2)4 |
| THIOSPINEL | Spinel (Co3O4, D72) | D72 | cF56 | (227, Fd-3m) | This is a sulphur spinel: (Cu,Fe,Mn)Cr2S4, Co3S4, FeNi2S4 and Ni3S4. | 3 | (CO, CU, FE, MN, NI)1(CO, CR, NI)2(S)4 |
| TI10O19 | Unknown Structure | 2 | (TI)10(O)19 | ||||
| TI20O39 | Ti20O39 | aP118 | (2, P-1) | 2 | (TI)20(O)39 | ||
| TI2NB10O29 | (Ti0.17Nb0.83)12O29 | mS82 | (12, C2/m) | 3 | (TI+4)2(NB+5)10(O-2)29 | ||
| TI2N_C4 | Rutile (TiO2, C4) | C4 | tP6 | (136, P4_2/mnm) | 2 | (TI)2(C, N)1 | |
| TI2S | Ta2P | oP36 | (58, Pnnm) | 2 | (TI)2(S)1 | ||
| TI3O2 | (Ti3O2) | hP5 | (191, P6/mmm) | 3 | (TI+2)2(TI)1(O-2)2 | ||
| TI4C2S2 | AlCCr2 | hP8 | (194, P6_3/mmc) | 3 | (TI)4(C)2(S)2 | ||
| TI5O9 | Ti5O9 | aP28 | (2, P-1) | Ti5O9 with solubility of V. | 2 | (TI, V)5(O)9 | |
| TI5P6O25 | Unknown Structure | 3 | (TI+4)5(P+5)6(O-2)25 | ||||
| TI8S10 | Ti0.81S | hP20 | (194, P6_3/mmc) | 2 | (TI)8(S)10 | ||
| TI8S3 | Ti8S3 | mS88 | (12, C2/m) | 2 | (TI)8(S)3 | ||
| TI8S9 | TiS | hR18 | (166, R-3m) | 2 | (TI)8(S)9 | ||
| TI9O17 | Ti9O17 | aP52 | (2, P-1) | 2 | (TI)9(O)17 | ||
| TINB24O62 | (Ti0.04Nb0.96)25O62 | mS174 | (5, C2) | 3 | (TI+4)1(NB+5)24(O-2)62 | ||
| TINB2O7 | (Ti0.33Nb0.67)3O7 | mS60 | (12, C2/m) | 3 | (TI+4)1(NB+5)2(O-2)7 | ||
| TIO_ALPHA | alpha-TiO | mS20 | (12, C2/m) | 2 | (TI+2)1(O-2)1 | ||
| TIS2 | CdI2 | hP3 | (164, P-3m1) | 2 | (TI)1(S)2 | ||
| TIS3 | ZrSe3 | mP8 | (11, P2_1/m) | 2 | (TI)1(S)3 | ||
| TRIDYMITE | Monoclinic (Cc) Low Tridymite (SiO2) | mS144 | (9, Cc) | SiO2 with AlPO4 solubility. | 2 | (AL+3, SI+4)1(PO4-3, SIO4-4)1 | |
| V2O5 | Shcherbinaite (V2O5) (Revised) | oP14 | (59, Pmmn) | 2 | (V+5)2(O-2)5 | ||
| V2O_SS | V7O3 | mS20 | (12, C2/m) | 2 | (V)1(O, VA)0.5 | ||
| V3O5_HT | V3O5-ht | mS32 | (15, C2/c) | This is ht-V3O5 with solubility of Al, Cr, Mg, Mn and Ti. | 2 | (AL, CR, MG, MN, TI, V)3(O)5 | |
| V3O5_LT | V3O5-lt | mP32 | (13, P2/c) | 2 | (V)3(O)5 | ||
| V3O7 | V3O7 | mS120 | (15, C2/c) | 2 | (V)3(O)7 | ||
| V52O64 | V13O16 | tI116 | (141, I4_1/amd) | 2 | (V)52(O)64 | ||
| V5O9 | Ti5O9 | aP28 | (2, P-1) | V5O9 with solubility of Ti. | 2 | (TI, V)5(O)9 | |
| V6O13 | V6O13 | mS38 | (12, C2/m) | 2 | (V)6(O)13 | ||
| VO2_LT | VO2 | mP12 | (14, P2_1/c) | This is lt-VO2, MoO2 and WO2. | 2 | (MO+4, V+4, W+4)1(O-2)2 | |
| WHITE_P | Unknown Structure | This is pure phosphorus. Not stable at normal conditions. | 1 | (P)1 | |||
| WO2_72 | Unknown Structure | 1 | (O2_72W1)1 | ||||
| WO2_90 | Unknown Structure | 1 | (O2_90W1)1 | ||||
| WO2_96 | Unknown Structure | 1 | (O2_96W1)1 | ||||
| WO3_HT | WO2.95 | tP16 | (113, P-42_1m) | 2 | (W+6)1(O-2)3 | ||
| WO3_LT | WO3 | oP32 | (60, Pbcn) | 2 | (W+6)1(O-2)3 | ||
| WOLLASTONITE | Wollastonite (CaSiO3) | aP30 | (2, P-1) | This is CaO.SiO2 with Ba, Fe, Mg and Mn solubility | 3 | (BA+2, CA+2, FE+2, MG+2, MN+2)1(SI+4)1(O-2)3 | |
| Y15C19_ALPHA | alpha-Y15C19 | oP18 | (55, Pbam) | 2 | (C)19(Y)15 | ||
| Y15C19_BETA | Unknown Structure | 2 | (C)19(Y)15 | ||||
| Y2C3_ALPHA | Sc3C4 | tP70 | (128, P4/mnc) | 3 | (Y)2(C)2(C, VA)1 | ||
| Y2C3_BETA | Unknown Structure | 3 | (Y)2(C)2(C, VA)1 | ||||
| Y2S2A_Y2SI2O7 | Thortveitite ([Sc,Y]2Si2O7, S21) | S21 | mS22 | (12, C2/m) | Y2Si2O7 | 3 | (Y+3)1(Y+3)1(SI2O7-6)1 |
| Y2S2B_Y2SI2O7 | La4Ge3[GeO4]O10 | aP44 | (2, P-1) | (Y,Yb)2Si2O7 solid solution. | 2 | (Y+3, YB+3)2(SI2O7-6)1 | |
| Y2S2D_Y2SI2O7 | Possible delta-Y2Si2O7 | oP44 | (62, Pnma) | Y2Si2O7 with Yb solubility. | 2 | (Y+3, YB+3)2(SI2O7-6)1 | |
| Y2S2G_Y2SI2O7 | Y2Si2O7-b | mP22 | (14, P2_1/c) | Y2Si2O7-b with Yb solubility. | 2 | (Y+3, YB+3)2(SI2O7-6)1 | |
| Y2SIO5 | Y2SiO5 (RE2SiO5 X2) | mS64 | (15, C2/c) | This is (Y,Yb)2SiO5 | 3 | (Y+3, YB+3)2(SIO4-4)1(O-2)1 | |
| Y2TIO5 | La2TiO5 | oP32 | (62, Pnma) | This is (Gd,La, Y)2TiO5 | 3 | (GD+3, LA+3, Y+3)2(TI+4)1(O-2)5 | |
| Y3NBO7 | Fluorite (CaF2, C1) | C1 | cF12 | (225, Fm-3m) | 3 | (NB+5, VA, Y+3)3(NB+5, Y+3)1(O-2, VA)7 | |
| YAM | Y4Al2O9 | mP60 | (14, P2_1/c) | This is Y4Al2O9, Gd4Al2O9 and Ca2Y2Si2O9 (Cuspidine) | 4 | (AL+3, SI+4)2(CA+2, GD+3, LA+3, Y+3, YB+3)4(O-2, VA)1(O-2)9 | |
| YAP | CaTiO3 Pnma Perovskite | oP20 | (62, Pnma) | This is Y(Al,Co,Cr,Fe)O3, YbFeO3 and Gd(Al,Co,Cr,Fe)O3. | 3 | (AL+3, CO+3, CR+3, FE+3, MN+3)1(CA+2, GD+3, LA+3, Y+3, YB+3)1(O-2, VA)3 | |
| YB2TIO5 | Fluorite (CaF2, C1) | C1 | cF12 | (225, Fm-3m) | 3 | (YB+3)2(TI+4)1(O-2)5 | |
| YB6HFO11 | Unknown Structure | Yb6HfO11 solid solution | 4 | (HF+4, YB+3)2(YB+3)6(O-2)12(O-2, VA)1 | |||
| YBO3 | Unknown Structure | This is (Y, Yb)BO3 solid solution. | 3 | (Y+3, YB+3)1(B+3)1(O-2)3 | |||
| YC_B1 | Rock Salt (NaCl, B1) | B1 | cF8 | (225, Fm-3m) | 2 | (Y)1(C, C2, VA)1 | |
| YNBO4 | LaNbO4 | mS24 | (15, C2/c) | 3 | (NB+5, VA, Y+3)1(NB+5, Y+3)1(O-2, VA)4 | ||
| ZIRCON | Zircon (ZrSiO4, S11) | S11 | tI24 | (141, I4_1/amd) | This is HfSiO4, ZrSiO4, GdPO4, LaPO4 and YPO4. | 3 | (P+5, SI+4)1(GD+3, HF+4, LA+3, Y+3, ZR+4)1(O-2, VA)4 |
| ZR11NB4O32 | Unknown Structure | 3 | (ZR+4)11(NB+5)4(O-2)32 | ||||
| ZR13NB4O36 | Unknown Structure | 3 | (ZR+4)13(NB+5)4(O-2)36 | ||||
| ZR15NB4O40 | Unknown Structure | 3 | (ZR+4)15(NB+5)4(O-2)40 | ||||
| ZR2P2O9 | Zr2[PO4]2O | mS52 | (12, C2/m) | 3 | (ZR+4)2(P+5)2(O-2)9 | ||
| ZR3Y4O12 | UY6O12 | hR19 | (148, R-3) | Zr3(Y,Yb)4O12 and Hf3Yb4O12. | 3 | (HF+4, ZR+4)3(Y+3, YB+3)4(O-2)12 | |
| ZR5NB2O15 | Unknown Structure | 3 | (ZR+4)5(NB+5)2(O-2)15 | ||||
| ZR6NB2O17 | Nb2Zr6O17 | oI100 | (46, Ima2) | 3 | (ZR+4)6(NB+5)2(O-2)17 | ||
| ZR7NB2O19 | Unknown Structure | 3 | (ZR+4)7(NB+5)2(O-2)19 | ||||
| ZR8NB2O21 | Unknown Structure | 3 | (ZR+4)8(NB+5)2(O-2)21 | ||||
| ZRF4 | ZrF4 | mS60 | (15, C2/c) | This is (Hf,Zr)F4. | 2 | (HF+4, ZR+4)1(F-1)4 | |
| ZRO2_MONO | Baddeleyite (ZrO2, C43) | C43 | mP12 | (14, P2_1/c) | This is Monoclinic HfO2 and ZrO2 | 2 | (AL+3, CA+2, CR+3, GD+3, HF+4, LA+3, TI+4, Y+3, YB+3, ZR+4)2(O-2, VA)4 |
| ZRO2_TETR | HgI2 (C13) | C13 | tP6 | (137, P4_2/nmc) | This is Tetragonal HfO2 and ZrO2 | 2 | (AL+3, BA+2, CA+2, CR+3, FE+2, GD+3, HF+4, LA+3, MG+2, MN+2, MN+3, NB+5, NI+2, TI+4, VA, Y+3, YB+3, ZR+4)2(O-2, VA)4 |
| ZRO8S2 | Zr[SO4]2 | oP44 | (62, Pnma) | 2 | (ZR+4)1(SO4-2)2 | ||
| ZRS2 | CdI2 | hP3 | (164, P-3m1) | 2 | (ZR)1(S)2 | ||
| ZRTI2O6 | Columbite (FeNb2O6, E51) | E51 | oP36 | (60, Pbcn) | 3 | (ZR+4)1(TI+4)2(O-2)6 | |
| ZRTIO4_ALPHA | Unknown Structure | 3 | (ZR+4)1(TI+4)1(O-2)4 | ||||
| ZRTIO4_BETA | zeta-Fe2N | oP12 | (60, Pbcn) | This is (Hf, Zr)TiO4 solid solution with Al solubility. | 3 | (AL+3, HF+4, TI+4, ZR+4)2(AL+3, VA)1(O-2)4 | |
| Z_PHASE | CrNbN | tP6 | (129, P4/nmm) | 3 | (CR, FE)1(MO, NB, V)1(N, VA)1 |
Gas and IONIC_LIQ Phase
| Name | Prototype | Note | Sublattices | Formula Unit |
|---|---|---|---|---|
|
GAS |
Gas |
|
1 |
(AL, AL1B1O2, AL1B3H12, AL1C1, AL1C2, AL1CU1, AL1CU1S1, AL1CU1S2, AL1F1, AL1F1H1, AL1F1H1O1, AL1F1H2, AL1F1H2O2, AL1F1O1, AL1F2, AL1F2H1, AL1F2H1O1, AL1F2NA1O1, AL1F2O1, AL1F3, AL1F4K1, AL1F4LI1, AL1F4NA1, AL1H1, AL1H1O1_ALOH, AL1H1O1_HALO, AL1H1O2, AL1H2, AL1H2O2, AL1H3, AL1H3O3, AL1N1, AL1O1, AL1O2, AL1P1, AL1P2, AL1S1, AL1S2, AL2, AL2C2, AL2C6H18, AL2F6, AL2F8NA2, AL2O1, AL2O2, AL2O3, AL2S1, AL2S2, AR, B, B10H14, B1BA1O2, B1C1, B1C1H3O1, B1C2, B1C2H7O2, B1C3H9, B1C3H9O3, B1C6H15, B1F1, B1F1H1, B1F1H1O1, B1F1H2, B1F1H2O2, B1F1O1, B1F2, B1F2H1, B1F2H1O1, B1F2O1, B1F3, B1F4K1, B1H1, B1H1O1_BOH, B1H1O1_HBO, B1H1O2, B1H1S1, B1H2, B1H2O1, B1H2O2, B1H3, B1H3O1, B1H3O2, B1H3O3, B1H6N1, B1K1O2, B1LI1O2, B1N1, B1NA1O2, B1O1, B1O2, B1S1, B1S2, B2, B2C1, B2F4, B2F4O1, B2H4O4, B2H6, B2O1, B2O2, B2O3, B2S1, B2S2, B2S3, B3F1H2O3, B3F2H1O3, B3F3O3, B3H3O3, B3H3O6, B3H6N3, B4S6, B5H9, BA, BA1F1, BA1F1H1O1, BA1F2, BA1H1, BA1H1O1, BA1H2O2, BA1MO1O4, BA1O1, BA1S1, BA2, BA2O1, BA2O2, C, C1F1, C1F1H1, C1F1H1O1, C1F1H2, C1F1H3, C1F1H4P1, C1F1N1, C1F1O1, C1F2, C1F2H1, C1F2H2, C1F2H3O1P1_1, C1F2H3O1P1_2, C1F2H3O1P1S1_O, C1F2H3O2P1, C1F2H3P1, C1F2H3P1S1_1, C1F2H3P1S1_2, C1F2N1P1, C1F2O1, C1F3, C1F3H1, C1F3H3SI1, C1F4, C1F4O1, C1F8S1, C1H1, C1H1N1_HCN, C1H1N1_HNC, C1H1N1O1, C1H1N1S1, C1H1O1, C1H1O2, C1H1P1, C1H1SI1_1, C1H1SI1_2, C1H2, C1H2N4, C1H2O1, C1H2O2_CIS, C1H2O2_DIOXIRANE, C1H2O2_TRANS, C1H2SI1_1, C1H2SI1_2, C1H3, C1H3O1_CH2OH, C1H3O1_CH3O, C1H3P1, C1H3SI1_1, C1H3SI1_2, C1H3SI1_3, C1H3SI1_4, C1H4, C1H4N2O1, C1H4O1, C1H4S1, C1H4SI1_1, C1H4SI1_2, C1H4SI1_3, C1H5N1, C1H5O1P1, C1H5O3P1, C1H5P1, C1H5P1S1, C1H5SI1_1, C1H5SI1_2, C1H6N1P1_N, C1H6N1P1_P, C1H6P2, C1H6SI1, C1K1N1, C1K2O3, C1N1, C1N1NA1, C1N1O1, C1N1O1_NCO, C1N2_CNN, C1N2_NCN, C1O1, C1O1S1, C1O2, C1P1, C1P1SI1, C1P1SI2, C1P2, C1S1, C1S2, C1SI1, C1SI2, C1SI3, C1SI4, C2, C2F1, C2F1H1, C2F1H3, C2F1H5, C2F1H6P1, C2F2, C2F2H2_1_1C2H2F2, C2F2H2_CIS, C2F2H2_TRANS, C2F2H4, C2F2H6N1P1, C2F3, C2F3H1, C2F3H3, C2F3N1, C2F4, C2F4H2, C2F5, C2F5H1, C2F6, C2H1, C2H10SI2, C2H1N1, C2H1SI1, C2H2, C2H2O1, C2H2SI1, C2H3, C2H3SI1_1, C2H3SI1_2, C2H4, C2H4O1_ACETALDEHYDE, C2H4O1_OXIRANE, C2H4O2_ACETICACID, C2H4O2_DIOXETANE, C2H4O3_123TRIOXOLANE, C2H4O3_124TRIOXOLANE, C2H4SI1_1, C2H4SI1_2, C2H5, C2H5SI1, C2H6, C2H6O1_1, C2H6O1_2, C2H6O1SI1, C2H6O2, C2H6SI1_1, C2H6SI1_2, C2H6SI1_3, C2H7O1P1, C2H7O3P1, C2H7P1_1, C2H7P1_2, C2H7P1S1, C2H7SI1_1, C2H7SI1_2, C2H8N1P1_N, C2H8N1P1_P, C2H8SI1, C2H8SI1_2, C2K2N2, C2N1_CCN, C2N1_CNC, C2N2, C2N2NA2, C2O1, C2P1, C2P2, C2SI1, C2SI2, C2SI3, C3, C3H1, C3H10SI1, C3H1N1, C3H4_1, C3H4_2, C3H6_1, C3H6_2, C3H6O1_1, C3H6O1_2, C3H8, C3H8SI1, C3H9SI1_1, C3H9SI1_2, C3N1, C3O2, C4, C4H1, C4H10_1, C4H10_2, C4H11SI1, C4H12SI1_1, C4H12SI1_2, C4H2_1, C4H2_2, C4H4_1, C4H4_2, C4H6_1, C4H6_2, C4H6_3, C4H6_4, C4H6_5, C4H8_1, C4H8_2, C4H8_3, C4H8_4, C4H8_5, C4H8_6, C4N1, C4N2, C4NI1O4, C5, C5FE1O5, C5H1N1, C5N1, C60, C6H6, C6H6O1, C6MO1O6, C6N1, C6N2, C9N1, CA, CA1F1, CA1F1H1O1, CA1F2, CA1H1, CA1H1O1, CA1H2O2, CA1O1, CA1S1, CA2, CO, CO1F1, CO1F2, CO1F3, CO1H1, CO1H1O1, CO1H2O2, CO1O1, CO1S1, CO2, CO2F4, CR, CR1F1, CR1F1O1, CR1F1O2, CR1F2, CR1F2O1, CR1F2O2, CR1F3, CR1F3O1, CR1F4, CR1F4O1, CR1F5, CR1F6, CR1H1, CR1H1O1, CR1H1O2, CR1H1O3, CR1H2O2, CR1H2O3, CR1H2O4, CR1H3O3, CR1H3O4, CR1H4O4, CR1H4O5, CR1N1, CR1O1, CR1O2, CR1O3, CR1S1, CR1S2, CR2, CR2O1, CR2O2, CR2O3, CU, CU1F1, CU1F2, CU1H1, CU1H1O1, CU1O1, CU1S1, CU2, CU2F2, CU2F4, CU2S1, CU3F3, CU4F4, F, F10MO2, F10S2, F15MO3, F1FE1, F1H1, F1H1N1, F1H1O1, F1H1O3S1, F1H1SI1, F1H2N1, F1H3SI1, F1K1, F1LI1, F1LI1O1, F1MG1, F1MN1, F1MN1O3, F1MO1, F1MO1O1, F1MO1O2, F1N1, F1N1O1, F1N1O2, F1N1O3, F1NA1, F1NI1, F1O1, F1O1S1, F1O1TI1, F1O1W1, F1O2_1, F1O2_2, F1O2_OFO, F1O2W1, F1P1, F1P1S1, F1S1, F1SI1, F1TI1, F1W1, F1Y1, F1YB1, F1ZR1, F2, F2FE1, F2H1N1, F2H2, F2H2SI1, F2K2, F2LI2, F2MG1, F2MN1, F2MO1, F2MO1O1, F2MO1O2, F2N1, F2N2_CIS, F2N2_TRANS, F2NA2, F2NI1, F2O1, F2O1S1, F2O1SI1, F2O1TI1, F2O1W1, F2O2, F2O2_FOOF, F2O2S1, F2O2W1, F2P1, F2S1, F2S2_FSSF, F2S2_SSF2, F2SI1, F2TI1, F2V1, F2W1, F2ZR1, F3FE1, F3GD1, F3H1SI1, F3H3, F3LA1, F3LI3, F3MN1, F3MO1, F3MO1O1, F3N1, F3N1O1, F3NA3, F3NB1O1, F3NI1, F3O1P1, F3O1V1, F3O1W1, F3P1, F3P1S1, F3S1, F3SI1, F3TI1, F3V1, F3W1, F3Y1, F3YB1, F3ZR1, F4FE2, F4H4, F4HF1, F4MG2, F4MN1, F4MO1, F4MO1O1, F4N2_GAUCH, F4N2_TRANS, F4NI2, F4O1S1, F4O1W1, F4S1, F4SI1, F4TI1, F4V1, F4W1, F4ZR1, F5H5, F5MO1, F5NB1, F5P1, F5S1, F5V1, F5W1, F6FE2, F6H6, F6MO1, F6S1, F6W1, F7H7, FE, FE1H1, FE1H1O1, FE1H1O2, FE1H2O2, FE1O1, FE1O2, FE1S1, FE2, GD, GD1O1, GD1S1, H, H1K1, H1K1O1, H1LI1, H1LI1O1, H1MG1, H1MG1O1, H1MN1, H1MN1O1, H1MO1O1, H1MO1O2, H1MO3, H1N1, H1N1O1, H1N1O2_CIS, H1N1O2_TRANS, H1N1O3, H1N3, H1NA1, H1NA1O1, H1NI1, H1NI1O1, H1O1, H1O1P1, H1O1S1_HSO, H1O1S1_SOH, H1O1W1, H1O2, H1O2W1, H1P1, H1S1, H1SI1, H1YB1, H1ZR1, H2, H2K2O2, H2LI2O2, H2MG1O2, H2MO1O2, H2MO1O3, H2MO1O4, H2N1, H2N2_1_1N2H2, H2N2_CIS, H2N2_TRANS, H2N2O2, H2NA2O2, H2NI1O2, H2O1, H2O1S1_H2SO, H2O1S1_HSOH, H2O2, H2O2W1, H2O3SI1, H2O3W1, H2O4S1, H2O4W1, H2P1, H2S1, H2S2, H2SI1, H3N1, H3N1O1, H3P1, H3SI1, H4N2, H4O4SI1, H4SI1, H6SI2, HF, HF1O1, HF1O2, K, K1LI1, K1N1O2, K1N1O3, K1NA1, K1O1, K1S1, K2, K2O1, K2O2, K2O4S1, K2S1, LA, LA1O1, LA1S1, LA2O1, LA2O2, LI, LI1N1, LI1N1O1, LI1N1O2, LI1N1O3, LI1NA1, LI1NA1O1, LI1O1, LI2, LI2O1, LI2O2, LI2O4S1, MG, MG1N1, MG1O1, MG1S1, MG2, MN, MN1O1, MN1O2, MN1S1, MO, MO1N1, MO1O1, MO1O2, MO1O3, MO1S1, MO1S2, MO2, MO2O6, MO3O9, MO4O12, MO5O15, N, N1NA1O2, N1NA1O3, N1NB1, N1O1, N1O2, N1O3, N1P1, N1S1, N1SI1, N1SI2, N1TI1, N1V1, N1ZR1, N2, N2O1, N2O2, N2O3, N2O4, N2O5, N3, NA, NA1O1, NA2, NA2O1, NA2O2, NA2O4S1, NB, NB1O1, NB1O2, NB1S1, NI, NI1O1, NI1S1, NI2, O, O10P4, O10V4, O12W4, O15W5, O1P1, O1S1, O1S2, O1SI1, O1TI1, O1V1, O1W1, O1Y1, O1Y2, O1YB1, O1ZR1, O2, O2P1, O2S1, O2SI1, O2SI2, O2TI1, O2V1, O2W1, O2Y1, O2Y2, O2ZR1, O3, O3P2, O3S1, O3W1, O4P2, O5P2, O6P3, O6P4, O6W2, O7P4, O8P4, O8W3, O9P4, O9W3, P, P1S1, P1SI1, P1SI2, P2, P2SI2, P3, P4, P4S3, S, S1SI1, S1TI1, S1V1, S1W1, S1Y1, S1YB1, S1ZR1, S2, S2SI1, S2TI1, S2W1, S2ZR1, S3, S4, S5, S6, S7, S8, SI, SI2, SI3, TI, TI2, V, W, Y, YB, ZR, ZR2)1 |
| IONIC_LIQ | Liquid |
Liquid metal and slag mixture |
2 |
(AL+3, BA+2, CA+2, CO+2, CR+2, CU+1, FE+2, GD+3, HF+4, K+1, LA+3, LI+1, MG+2, MN+2, MO+4, NA+1, NB+2, NI+2, P+5, SI+4, TI+2, V+2, W+6, Y+3, YB+3, ZR+4)P(ALN, ALO2-1, B, BO3-3, BO3/2, C, C3S2Z_1/6, CO3-2, COF3, COO3/2, CRF3, CRO3/2, CUF2, CUO, F-1, FEF3, FEO3/2, M3S2Z_1/6, MNO3/2, MOO3, N, NBF5, NBO5/2, NO3-1, O-2, PO4-3, PO5/2, S, S-2, SIO2, SIO4-4, TIO2, TIO3/2, VA, VO2, VO3/2, VO5/2)Q |