PanMo2025:List of All Phases
Phases (208)
| Name | Model | Lattice Size | Constituent |
|---|---|---|---|
| ABMo | CEF (SLN) | (0.5)(0.5) | (Cr,Mo,Ti)(B,Va) |
| ALPHA_RHOMBO_B | CEF (ST1) | (1) | (B) |
| A_TiO | CEF (ST2) | (1)(1) | (Ti)(O) |
| Al11Cr2 | CEF (ST2) | (10)(1)(2) | (Al)(Al)(Cr) |
| Al11Mn4 | CEF (SLN) | (11)(4) | (Al)(Fe,Mn) |
| Al11Mn4_HT | CEF (SLN) | (29)(10) | (Al,Mn)(Mn) |
| Al11Re4 | CEF (ST2) | (11)(4) | (Al)(Re) |
| Al12Mn | CEF (SLN) | (12)(1) | (Al)(Fe,Mn) |
| Al12Mo | CEF (ST2) | (0.923)(0.077) | (Al)(Mo) |
| Al12Re | CEF (ST2) | (12)(1) | (Al)(Re) |
| Al13Cr2 | CEF (ST2) | (13)(2) | (Al)(Cr) |
| Al13Fe4 | CEF (SLN) | (0.6275)(0.235)(0.1375) | (Al)(Fe,Mn)(Al,Si,Va) |
| Al15_FeMn3Si2 | CEF (SLN) | (16)(4)(1)(2) | (Al)(Fe,Mn)(Si)(Al,Si) |
| Al1Fe1O3 | CEF (ST3) | (1)(1)(3) | (Al+3)(Fe+3)(O-2) |
| Al2Fe | CEF (SLN) | (2)(1) | (Al)(Fe,Mn) |
| Al2Hf | CEF (ST2) | (0.666667)(0.333333) | (Al)(Hf) |
| Al2Hf3 | CEF (ST2) | (0.4)(0.6) | (Al)(Hf) |
| Al2Ti | CEF (ST2) | (2)(1) | (Al)(Ti) |
| Al2Zr | CEF (SLN) | (0.666667)(0.333333) | (Al,Mo)(Zr) |
| Al2Zr3 | CEF (ST2) | (0.4)(0.6) | (Al)(Zr) |
| Al3Hf | CEF (ST2) | (0.75)(0.25) | (Al)(Hf) |
| Al3Hf2 | CEF (ST2) | (0.6)(0.4) | (Al)(Hf) |
| Al3Hf4 | CEF (ST2) | (0.428571)(0.571429) | (Al)(Hf) |
| Al3Ti | CEF (SLN) | (0.25)(0.75) | (Al,Ti)(Al,Ti) |
| Al3Zr | CEF (ST2) | (0.75)(0.25) | (Al)(Zr) |
| Al3Zr2 | CEF (ST2) | (0.6)(0.4) | (Al)(Zr) |
| Al3Zr4 | CEF (ST2) | (0.42857)(0.57143) | (Al)(Zr) |
| Al3Zr5 | CEF (ST2) | (0.375)(0.625) | (Al)(Zr) |
| Al4C3 | CEF (SLN) | (4)(3) | (Al,Mo,Si)(C) |
| Al4Cr | CEF (ST2) | (4)(1) | (Al)(Cr) |
| Al4Mn | CEF (SLN) | (4)(1) | (Al)(Fe,Mn) |
| Al4Mn_L | CEF (ST2) | (461)(107) | (Al)(Mn) |
| Al4Mo | CEF (SLN) | (0.8)(0.2) | (Al,Fe)(Mo) |
| Al4Mo3Ti3 | CEF (ST3) | (4)(3)(3) | (Al)(Mo)(Ti) |
| Al4Re | CEF (ST2) | (4)(1) | (Al)(Re) |
| Al4Zr5 | CEF (ST2) | (0.444444)(0.555556) | (Al)(Zr) |
| Al5Fe2 | CEF (SLN) | (5)(2) | (Al)(Fe,Mn) |
| Al5Fe4 | CEF (SLN) | (1) | (Al,Fe,Mn) |
| Al5Mo | CEF (ST2) | (0.833)(0.167) | (Al)(Mo) |
| Al5Ti2 | CEF (ST2) | (5)(2) | (Al)(Ti) |
| Al63Mo37 | CEF (ST2) | (0.63)(0.37) | (Al)(Mo) |
| Al6Re | CEF (ST2) | (6)(1) | (Al)(Re) |
| Al6_FeMn | CEF (SLN) | (6)(1) | (Al)(Fe,Mn) |
| Al8Cr5_H | CEF (ST2) | (8)(5) | (Al)(Cr) |
| Al8Cr5_L | CEF (ST2) | (8)(5) | (Al)(Cr) |
| Al8FeMnSi2 | CEF (ST4) | (16)(2)(2)(3) | (Al)(Fe)(Mn)(Si) |
| Al8FeMo3 | CEF (SLN) | (8)(1)(3) | (Al)(Al,Fe)(Mo) |
| Al8Mn5 | CEF (SLN) | (12)(5)(9) | (Al)(Mn)(Al,Mn) |
| Al8Mo3 | CEF (ST2) | (0.727)(0.273) | (Al)(Mo) |
| Al9Cr4_H | CEF (ST2) | (9)(4) | (Al)(Cr) |
| Al9Cr4_L | CEF (ST2) | (9)(4) | (Al)(Cr) |
| AlB12_Alpha | CEF (ST2) | (1)(12) | (Al)(B) |
| AlCr2 | CEF (ST2) | (1)(2) | (Al)(Cr) |
| AlHf | CEF (ST2) | (0.5)(0.5) | (Al)(Hf) |
| AlHf2 | CEF (ST2) | (0.333333)(0.666667) | (Al)(Hf) |
| AlMnSi_Beta | CEF (SLN) | (15)(1)(4)(6) | (Al)(Si)(Al,Si)(Mn) |
| AlMoSi_C54 | CEF (ST3) | (0.434)(0.333)(0.233) | (Al)(Mo)(Si) |
| AlRe | CEF (ST2) | (1)(1) | (Al)(Re) |
| AlRe2 | CEF (ST2) | (1)(2) | (Al)(Re) |
| AlTi | CEF (SLN) | (0.5)(0.5) | (Al,Ti)(Al,Ti) |
| AlTi3 | CEF (SLN) | (0.75)(0.25) | (Al,Ti)(Al,Ti) |
| AlZr | CEF (ST2) | (0.5)(0.5) | (Al)(Zr) |
| AlZr2 | CEF (ST2) | (0.333333)(0.666667) | (Al)(Zr) |
| AlZr3 | CEF (ST2) | (0.25)(0.75) | (Al)(Zr) |
| Alpha-Mn2B | CEF (ST2) | (0.670691)(0.329309) | (Mn)(B) |
| Alpha_AlFeSi | CEF (SLN) | (0.66)(0.19)(0.05)(0.1) | (Al)(Fe)(Si)(Al,Si) |
| B2 | CEF (SLN) | (1)(1) | (Al,Cr,Fe,Hf,Mn,Mo,Re,Si,Ti) (Al,Cr,Fe,Hf,Mn,Mo,Re,Si,Ti,Va) |
| B2O3 | CEF (ST2) | (2)(3) | (B)(O) |
| B3Si | CEF (SLN) | (6)(2)(6) | (B)(Si)(B,Si) |
| B4C | CEF (SLN) | (1)(1) | (B12,B11C)(B2,B2C,BC2) |
| B4Mo | CEF (ST2) | (0.8)(0.2) | (B)(Mo) |
| B5Mo2 | CEF (SLN) | (2)(5) | (Mo)(B,Va) |
| B6Si | CEF (SLN) | (210)(23)(48) | (B)(Si)(B,Si) |
| BETA_RHOMBO_B | CEF (SLN) | (93)(12) | (B,Re)(B,Mn,Si,Zr) |
| BMo | CEF (SLN) | (0.5)(0.5) | (B)(Mo,Ti) |
| B_NSi | CEF (SLN) | (61)(1)(8) | (B)(Si)(B,Si) |
| Bcc | CEF (SLN) | (1)(3) | (Al,B,Cr,Fe,Hf,Mn,Mo,Re,Si,Ti,Zr) (B,C,O,Va) |
| Bcc_B2 | CEF (SLN) | (0.5)(0.5)(3) | (Al,Fe,Si)(Al,Fe,Si)(Va) |
| Beta_AlFeSi | CEF (SLN) | (0.598)(0.152)(0.1)(0.15) | (Al)(Fe,Mn)(Si)(Al,Si) |
| CBCC_A12 | CEF (SLN) | (1)(1) | (Al,Cr,Fe,Mn,Mo,Re,Si,Ti,Zr)(C,Va) |
| CUB_A13 | CEF (SLN) | (1)(1) | (Al,Cr,Fe,Hf,Mn,Mo,Si,Ti,Zr)(C,Va) |
| Cementite | CEF (SLN) | (3)(1) | (Cr,Fe,Mo)(C) |
| Chi_A12 | CEF (SLN) | (24)(10)(24) | (Cr,Fe,Re)(Cr,Mo,Re)(Cr,Fe,Mo,Re) |
| Corundum | CEF (SLN) | (2)(1)(3) | (Al+3,Cr+2,Cr+3,Fe+2,Fe+3,Ti+3,Va) (Cr+3,Fe+3,Va)(O-2) |
| Cr3B4 | CEF (ST2) | (0.429)(0.571) | (Cr)(B) |
| Cr3Mn5 | CEF (ST2) | (3)(5) | (Cr)(Mn) |
| Cr5B3 | CEF (ST2) | (0.625)(0.375) | (Cr)(B) |
| CrB | CEF (ST2) | (0.5)(0.5) | (Cr)(B) |
| CrB2 | CEF (SLN) | (0.333)(0.667) | (Cr)(B,Va) |
| CrB4 | CEF (ST2) | (0.2)(0.8) | (Cr)(B) |
| CrSi | CEF (ST2) | (0.5)(0.5) | (Cr)(Si) |
| CrSi2 | CEF (ST2) | (1)(2) | (Cr)(Si) |
| Cristobalite | CEF (ST2) | (1)(2) | (Si)(O) |
| DISORDER | CEF (SLN) | (1) | (Al,Cr) |
| Delta | CEF (SLN) | (3)(1) | (Al,Cr,Fe,Mo,Re,Ti)(Al,Cr,Fe,Hf,Mo,Ti) |
| Diamond | CEF (SLN) | (1) | (Al,B,C,Si,Ti) |
| Eta | CEF (SLN) | (0.75)(0.25) | (Fe,Ti)(Al,Cr,Hf,Mo,Ti) |
| Fcc | CEF (SLN) | (1)(1) | (Al,B,Cr,Fe,Hf,Mn,Mo,Re,Si,Ti,Zr) (B,C,O,Va) |
| Fe23Zr6 | CEF (ST2) | (0.793)(0.207) | (Fe)(Zr) |
| Fe2Si | CEF (ST2) | (0.666667)(0.333333) | (Fe)(Si) |
| Fe4Re | CEF (SLN) | (4)(1) | (Fe,Re)(Fe,Re) |
| Fe5Si3 | CEF (ST2) | (0.625)(0.375) | (Fe)(Si) |
| FeHf2 | CEF (ST2) | (0.3333)(0.6667) | (Fe)(Hf) |
| FeMo3Si | CEF (ST3) | (1)(3)(1) | (Fe)(Mo)(Si) |
| FeSi | CEF (ST2) | (0.5)(0.5) | (Fe)(Si) |
| FeSi2_H | CEF (ST2) | (3)(7) | (Fe)(Si) |
| FeSi2_L | CEF (ST2) | (1)(2) | (Fe)(Si) |
| FeZr2 | CEF (SLN) | (1)(2) | (Fe,Zr)(Fe,Zr) |
| FeZr3 | CEF (SLN) | (1)(3) | (Fe,Zr)(Fe,Zr) |
| GAS | GAS | (1) | (B,B2,Mn,Mo,MO2,Re,Si,Si2,Si3,Al, AlO,AlO2,Al2,Al2O,Al2O2,Al2O3, C1O1,C1O2,Fe,FeO,FeO2,Fe2,Hf, HfO,HfO2,O,O2,O3,SiO,SiO2, Ti,TiO,TiO2,Zr,Zr2,ZrO,ZrO2) |
| Gamma_AlFeSi | CEF (ST3) | (0.635)(0.205)(0.16) | (Al)(Fe)(Si) |
| Graphite | CEF (SLN) | (1) | (B,C) |
| H_Sigma | CEF (SLN) | (8)(4)(18) | (Mn)(Cr)(Cr,Mn) |
| Halite | CEF (SLN) | (1)(1) | (Al+3,Cr+3,Fe+2,Fe+3,Mn+2,Mn+3,Va) (O-2,Va) |
| Hcp | CEF (SLN) | (1)(0.5) | (Al,Cr,Fe,Hf,Mn,Mo,Re,Si,Ti,Zr) (B,C,O,Va) |
| HfMn | CEF (ST2) | (0.5)(0.5) | (Hf)(Mn) |
| HfMn2 | CEF (SLN) | (1)(2) | (Hf,Mn)(Hf,Mn) |
| HfSiO4 | CEF (ST3) | (1)(1)(4) | (Hf)(Si)(O) |
| L10_FCC | CEF (SLN) | (0.5)(0.5) | (Al,Ti)(Al,Ti) |
| L12_FCC | CEF (SLN) | (0.75)(0.25) | (Al,Cr)(Al,Cr) |
| Laves_C14 | CEF (SLN) | (2)(1) | (Al,Cr,Fe,Hf,Mo,Ti,Zr) (Al,Cr,Fe,Hf,Mo,Ti,Zr) |
| Laves_C15 | CEF (SLN) | (2)(1) | (Al,Cr,Fe,Hf,Mo,Ti,Zr,Si) (Al,Cr,Fe,Hf,Mo,Ti,Zr) |
| Laves_C36 | CEF (SLN) | (2)(1) | (Cr,Zr)(Cr,Zr) |
| Liquid | CEF (SLN) | (1) | (Al,B,C,Cr,Fe,Hf,Mn,Mo,Re,Si,Ti, Zr,O,Al2O3,B2O3,Cr2/3O,FeO, FeO3/2,HfO2,MnO,Mn2/3O, MoO2,MoO3,SiO2,TiO,TiO3/2, TiO2,Zr1/2O) |
| M23C6 | CEF (SLN) | (23)(6) | (Cr,Fe,Mn,Mo)(C) |
| M2B_Ti12 | CEF (SLN) | (0.333)(0.667) | (B,Si)(Cr,Fe,Hf,Mn,Mo,Re,Ti,Zr) |
| M3B2 | CEF (SLN) | (2)(3) | (B,Si)(Fe,Mn,Mo,Hf,Zr) |
| M3B4 | CEF (SLN) | (4)(3) | (B)(Hf,Mn,Ti) |
| M3C2 | CEF (SLN) | (3)(2) | (Cr,Mo)(C) |
| M7C3 | CEF (SLN) | (7)(3) | (Cr,Fe,Mn,Mo,Re)(C) |
| MB2_HP3 | CEF (SLN) | (1)(2) | (Al,Cr,Hf,Mn,Mo,Ti,Zr)(B,Va) |
| MB_OP8 | CEF (SLN) | (1)(1) | (B,Si)(Fe,Hf,Mn,Mo,Ti,Zr) |
| MSi2_C11b | CEF (SLN) | (0.333)(0.667) | (Mo,Re)(Al,Si,Va) |
| MSi2_Ti6 | CEF (SLN) | (1)(2) | (Mo,Re)(Al,Si,Va) |
| Mn11Si19 | CEF (ST2) | (11)(19) | (Mn)(Si) |
| Mn3C | CEF (ST2) | (3)(1) | (Mn)(C) |
| Mn3O4_A | CEF (ST2) | (3)(4) | (Mn)(O) |
| Mn3O4_B | CEF (ST2) | (3)(4) | (Mn)(O) |
| Mn3Si | CEF (ST2) | (3)(1) | (Mn)(Si) |
| Mn5C2 | CEF (ST2) | (5)(2) | (Mn)(C) |
| Mn6Si | CEF (ST2) | (17)(3) | (Mn)(Si) |
| Mn9Si2 | CEF (ST2) | (33)(7) | (Mn)(Si) |
| MnB4 | CEF (ST2) | (0.2)(0.8) | (Mn)(B) |
| Mo2BC | CEF (ST3) | (2)(1)(1) | (Mo)(B)(C) |
| Mo2Fe21C6 | CEF (ST3) | (2)(21)(6) | (Mo)(Fe)(C) |
| Mo2Hf | CEF (SLN) | (2)(1)(1) | (Hf,Mo,Si)(Hf,Mo)(C,Va) |
| Mo2Mn4C | CEF (ST3) | (2)(4)(1) | (Mo)(Mn)(C) |
| Mo3Al2C | CEF (ST3) | (3)(2)(1) | (Mo)(Al)(C) |
| Mo3M3C | CEF (SLN) | (3)(3)(1) | (Mo)(Fe,Mn)(C) |
| Mo3Si | CEF (SLN) | (0.75)(0.25) | (Cr,Fe,Hf,Mo,Re,Si,Ti,Zr) (Al,Cr,Fe,Re,Si) |
| Mo4O11 | CEF (ST2) | (0.266667)(0.733333) | (Mo)(O) |
| Mo4Si9Ti7 | CEF (SLN) | (0.55)(0.45) | (Mo,Ti)(Si) |
| Mo5Si3 | CEF (SLN) | (0.625)(0.375) | (Cr,Mo,Re,Si,Ti,Zr)(Al,B,Mo,Si) |
| Mo5Si3C | CEF (ST3) | (4.8)(3)(0.6) | (Mo)(Si)(C) |
| Mo5SiB2 | CEF (SLN) | (0.625)(0.125)(0.25) | (Fe,Hf,Mn,Mo,Re,Ti,Zr)(B,Si)(B) |
| Mo8O23 | CEF (ST2) | (0.258064)(0.741935) | (Mo)(O) |
| Mo9O26 | CEF (ST2) | (0.257143)(0.742857) | (Mo)(O) |
| MoO3 | CEF (ST2) | (1)(3) | (Mo)(O) |
| MoSi6Ti2 | CEF (SLN) | (1)(2) | (Mo,Ti)(Si) |
| MoSiZr | CEF (SLN) | (1)(1)(1) | (Mo)(Si)(Hf,Mo,Zr) |
| Mu_Phase | CEF (SLN) | (7)(2)(4) | (Al,Cr,Fe,Mn,Mo,Re,Si)(Cr,Mo,Re,Ti) (Cr,Fe,Mo,Re,Ti) |
| P_PHASE | CEF (SLN) | (24)(12)(20) | (Cr,Fe,Re)(Mo)(Cr,Fe,Mo,Re) |
| Quartz | CEF (ST2) | (1)(2) | (Si)(O) |
| R_Phase | CEF (SLN) | (27)(14)(12) | (Cr,Fe,Si)(Mo)(Cr,Fe,Mo) |
| Re24Ti5 | CEF (ST2) | (24)(5) | (Re)(Ti) |
| Re2O7 | CEF (ST2) | (2)(7) | (Re)(O) |
| Re2Si | CEF (ST2) | (2)(1) | (Re)(Si) |
| Re3B | CEF (SLN) | (0.75)(0.25) | (Mo,Re)(B) |
| Re7B3 | CEF (SLN) | (0.3)(0.7) | (B)(Mo,Re) |
| ReB2 | CEF (SLN) | (1)(2) | (B,Re)(B) |
| ReO2 | CEF (ST2) | (1)(2) | (Re)(O) |
| ReO3 | CEF (ST2) | (1)(3) | (Re)(O) |
| ReSi | CEF (SLN) | (1)(1) | (Mn,Re)(Si) |
| ReTi | CEF (ST2) | (1)(1) | (Re)(Ti) |
| Rutile | CEF (SLN) | (1)(2) | (Mn+4,Ti+3,Ti+4)(O-2,Va) |
| Shp_MC | CEF (ST2) | (1)(1) | (Mo)(C) |
| Si2Ti | CEF (SLN) | (2)(1) | (Si)(Mo,Ti) |
| Si2Zr | CEF (SLN) | (2)(1) | (Si)(Hf,Zr) |
| Si3Ti5 | CEF (SLN) | (0.375)(0.625) | (Si)(Hf,Mn,Mo,Ti,Zr) |
| Si4Ti5 | CEF (SLN) | (4)(5) | (Si)(Hf,Mo,Ti,Zr) |
| SiC | CEF (ST2) | (1)(1) | (C)(Si) |
| SiO_AM | CEF (ST2) | (1)(1) | (Si)(O) |
| SiTi3 | CEF (SLN) | (1)(3) | (Si)(Ti,Zr) |
| Sigma | CEF (SLN) | (10)(4)(16) | (Al,Fe,Mn,Re,Si)(Cr,Fe,Mo,Re) (Al,Cr,Fe,Mn,Mo,Re,Si) |
| Spinel | CEF (SLN) | (1)(2)(2)(4) | (Al+3,Cr+2,Cr+3,Fe+2,Fe+3) (Al+3,Cr+3,Fe+2,Fe+3,Va) (Fe+2,Va)(O-2) |
| T_AlFeMo | CEF (SLN) | (1) | (Al,Fe,Mo) |
| Ti10O19 | CEF (ST2) | (10)(19) | (Ti)(O) |
| Ti20O39 | CEF (ST2) | (20)(39) | (Ti)(O) |
| Ti3O2 | CEF (ST2) | (3)(2) | (Ti)(O) |
| Ti3O5 | CEF (ST2) | (3)(5) | (Ti)(O) |
| Ti4O7 | CEF (ST2) | (4)(7) | (Ti)(O) |
| Ti5O9 | CEF (ST2) | (5)(9) | (Ti)(O) |
| Ti6O11 | CEF (ST2) | (6)(11) | (Ti)(O) |
| Ti6Si2B | CEF (ST3) | (6)(2)(1) | (Ti)(Si)(B) |
| Ti7O13 | CEF (ST2) | (7)(13) | (Ti)(O) |
| Ti8O15 | CEF (ST2) | (8)(15) | (Ti)(O) |
| Ti9O17 | CEF (ST2) | (9)(17) | (Ti)(O) |
| TiOx | CEF (SLN) | (1)(1)(1) | (Ti+2,Ti+3,Va)(Ti,Va)(O-2) |
| Tridymite | CEF (ST2) | (1)(2) | (Si)(O) |
| VO2 | CEF (SLN) | (1)(2) | (Hf,Mo,Zr)(O) |
| Y2O3_cub | CEF (SLN) | (2)(3)(1) | (Mn+3,Va)(O-2)(O-2,Va) |
| Y2O3_hex | CEF (SLN) | (2)(3)(1) | (Zr+4)(O-2)(O-2,Va) |
| Zr2O | CEF (ST2) | (2)(1) | (Zr)(O) |
| Zr3O | CEF (ST2) | (3)(1) | (Zr)(O) |
| Zr6O | CEF (ST2) | (6)(1) | (Zr)(O) |
| ZrB12 | CEF (ST2) | (1)(12) | (Zr)(B) |
| ZrO2_Cubic | CEF (SLN) | (1)(2) | (Hf,Zr)(O,Va) |
| ZrO2_Tetragonal | CEF (SLN) | (1)(2) | (Hf,Zr)(O,Va) |