|
fig# |
type |
psymbol |
dE[eV/at] |
dH[eV/at] |
drb |
dri |
nat |
nn_spec |
ch_spec |
stab |
encut |
ext |
info | 4 | Ce2Ni7 | hP36 | STABLE | -0.3829 | - | 0.17 | 36 | 28:8 | Ni:Y_sv | ? | m270 | - |
info | 1 | Be3Nb | hR12 | STABLE | -0.4059 | - | 0.01 | 12 | 9:3 | Ni:Y_sv | ? | m270 | - |
info | 3 | CaCu5 | hP6 | STABLE | -0.3291 | - | - | 6 | 5:1 | Ni:Y_sv | ? | m270 | - |
info | 17 | NiY | mP8 | STABLE | -0.4469 | - | 0.02 | 8 | 4:4 | Ni:Y_sv | ? | m270 | - |
info | - | Mg | hP2 | STABLE | -0.0000 | - | - | 2 | 2 | Y_sv | ? | m270 | - |
info | 5 | CFe3 | oP16 | STABLE | -0.2466 | - | 0.16 | 16 | 4:12 | Ni:Y_sv | ? | m270 | - |
info | - | Cu | cF4 | STABLE | 0.0000 | - | - | 4 | 4 | Ni | ? | m270 | - |
info | 7 | Cu2Mg | cF24 | STABLE | -0.4250 | - | - | 6 | 4:2 | Ni:Y_sv | ? | m270 | - |
info | 16 | Ni2Y3 | tP80 | STABLE | -0.3672 | - | 0.06 | 80 | 32:48 | Ni:Y_sv | ? | m270 | - |
info | 2 | BFe | oP8 | 0.0004 | -0.4464 | - | 0.01 | 8 | 4:4 | Ni:Y_sv | ? | m270 | - |
info | 14 | Ni17Th2 | hP38 | 0.0032 | -0.2046 | - | 0.34 | 38 | 34:4 | Ni:Y_sv | ? | m270 | - |
info | - | La | hP4 | 0.00754 | 0.0075 | - | - | 4 | 4 | Y_sv | ? | m270 | - |
info | - | Cu | cF4 | 0.025305 | 0.0253 | - | - | 4 | 4 | Y_sv | ? | m270 | - |
info | - | W | cI2 | 0.124023 | 0.1240 | - | - | 2 | 2 | Y_sv | ? | m270 | - |
info | - | Cu2Mg | cF24 | 0.221796 | 0.2218 | - | - | 6 | 6 | Ni | ? | m270 | - |
info | - | Cu2Mg | cF24 | 0.252865 | 0.2529 | - | - | 6 | 6 | Y_sv | ? | m270 | - |
info | 6 | Cu2Mg | cF24 | 1.2226 | 0.9090 | - | - | 6 | 2:4 | Ni:Y_sv | ? | m270 | - |
info | 15 | Ni19Th2 | hP80 | 485.4608 | 485.2583 | - | - | 39 | 35:4 | Ni:Y_sv | ? | m270 | - |
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