PanMo: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) |
|
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) |
|
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) |
|
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) |
|
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, |
|
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) |
|
Hcp |
CEF (SLN) |
(1)(0.5) |
(Al,Cr,Fe,Hf,Mn,Mo,Re,Si,Ti,Zr) |
|
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) |
|
Laves_C15 |
CEF (SLN) |
(2)(1) |
(Al,Cr,Fe,Hf,Mo,Ti,Zr,Si) |
|
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, |
|
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) |
|
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) |
|
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) |
|
Spinel |
CEF (SLN) |
(1)(2)(2)(4) |
(Al+3,Cr+2,Cr+3,Fe+2,Fe+3) |
|
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) |