|
fig# |
type |
psymbol |
dE[eV/at] |
dH[eV/at] |
drb |
dri |
nat |
nn_spec |
ch_spec |
stab |
encut |
ext |
info | 4 | CaCu5 | hP6 | STABLE | -0.2820 | - | - | 6 | 1:5 | Nd_3:Ni | ? | m270 | - |
info | - | Cu | cF4 | STABLE | 0.0000 | - | - | 4 | 4 | Ni | ? | m270 | - |
info | 6 | CFe3 | oP16 | STABLE | -0.1789 | - | 0.14 | 16 | 12:4 | Nd_3:Ni | ? | m270 | - |
info | - | La | hP4 | STABLE | -0.0000 | - | - | 4 | 4 | Nd_3 | ? | m270 | - |
info | 2 | BCr | oC8 | STABLE | -0.3321 | - | 0.08 | 4 | 2:2 | Nd_3:Ni | ? | m270 | - |
info | 3 | Be3Nb | hR12 | STABLE | -0.3346 | - | 0.05 | 12 | 3:9 | Nd_3:Ni | ? | m270 | - |
info | 7 | Co7Er2 | hR18 | 0.0008 | -0.3163 | - | 0.11 | 18 | 4:14 | Nd_3:Ni | ? | m270 | - |
info | 13 | Fe3Th7 | hP20 | 0.0043 | -0.2052 | - | 0.13 | 20 | 14:6 | Nd_3:Ni | ? | m270 | - |
info | 5 | Ce2Ni7 | hP36 | 0.0052 | -0.3119 | - | 0.18 | 36 | 8:28 | Nd_3:Ni | ? | m270 | - |
info | 15 | Ni17Th2 | hP38 | 0.0070 | -0.1711 | - | 0.37 | 38 | 4:34 | Nd_3:Ni | ? | m270 | - |
info | 8 | Cu2Mg | cF24 | 0.0160 | -0.3177 | - | - | 6 | 2:4 | Nd_3:Ni | ? | m270 | - |
info | 1 | Al4Ba | tI10 | 0.1561 | -0.1470 | - | 0.09 | 5 | 1:4 | Nd_3:Ni | ? | m270 | - |
info | - | Cu2Mg | cF24 | 0.221796 | 0.2218 | - | - | 6 | 6 | Ni | ? | m270 | - |
info | - | Cu2Mg | cF24 | 0.244778 | 0.2448 | - | - | 6 | 6 | Nd_3 | ? | m270 | - |
info | 9 | Cu2Mg | cF24 | 1.1387 | 0.9088 | - | - | 6 | 4:2 | Nd_3:Ni | ? | m270 | - |
 |