|
type |
psymbol |
dE[eV/at] |
dH[eV/at] |
drb |
dri |
nat |
nn_spec |
ch_spec |
stab |
encut |
ext |
| info | B4CrY | oP24 | 0.0031 | -0.6569 | 0.03 | 0.15 | 24 | 16:4:1:3 | B:Fe:Y_sv:Zr | ? | m319 | - |
| info | B4CrY | oP24 | 0.0040 | -0.6233 | 0.04 | 0.14 | 24 | 16:4:3:1 | B:Fe:Y_sv:Zr | ? | m319 | - |
| info | B4CrY | oP24 | 0.0044 | -0.6393 | 0.06 | 0.14 | 24 | 16:4:2:2 | B:Fe:Y_sv:Zr | ? | s319 | - |
| info | BFe14Nd2 | tP68 | 0.0052 | -0.1169 | 0.02 | 0.03 | 68 | 4:56:7:1 | B:Fe:Y_sv:Zr | ? | m319 | - |
| info | B7ReY3 | oC44 | 0.0211 | -0.6314 | 0.06 | 0.09 | 22 | 14:2:5:1 | B:Fe:Y_sv:Zr | ? | m319 | - |
| info | BFe14Nd2 | tP68 | 0.0219 | -0.1206 | - | 0.07 | 68 | 4:56:4:4 | B:Fe:Y_sv:Zr | ? | m319 | - |
| info | BCeCo4 | hP12 | 0.0232 | -0.2658 | - | 0.01 | 12 | 2:8:1:1 | B:Fe:Y_sv:Zr | ? | m319 | - |
| info | B7ReY3 | oC44 | 0.0284 | -0.6241 | 0.05 | 0.08 | 22 | 14:2:5:1 | B:Fe:Y_sv:Zr | ? | m319 | Y2-Zr |
| info | B4Co4Nd | tP18 | 0.0338 | -0.4810 | 0.03 | 0.17 | 18 | 8:8:1:1 | B:Fe:Y_sv:Zr | ? | m319 | - |
| info | B6ReY2 | oP36 | 0.0360 | -0.6052 | 0.04 | 0.12 | 36 | 24:4:7:1 | B:Fe:Y_sv:Zr | ? | m319 | - |
| info | BFe14Nd2 | tP68 | 0.0379 | -0.1046 | - | 0.12 | 68 | 4:56:4:4 | B:Fe:Y_sv:Zr | ? | m319 | v2 |
| info | C6Cr23 | cF116 | 0.0459 | -0.2112 | 0.07 | 0.11 | 29 | 6:21:1:1 | B:Fe:Y_sv:Zr | ? | m319 | - |
| info | B6Co3Tb4 | hR13 | 0.0495 | -0.5191 | 0.03 | 0.22 | 13 | 6:2:4:1 | B:Fe:Y_sv:Zr | ? | m319 | - |
| info | *CaCu5-1x1x2 | - | 0.0535 | -0.4028 | - | - | 12 | 4:6:1:1 | B:Fe:Y_sv:Zr | ? | m319 | - |
| info | B6Co3Tb4 | hR13 | 0.0607 | -0.5079 | 0.02 | 0.20 | 13 | 6:2:4:1 | B:Fe:Y_sv:Zr | ? | m319 | Nd2-Zr |
| info | Al4Ba | tI10 | 0.0630 | -0.4815 | 0.22 | 0.14 | 10 | 4:4:1:1 | B:Fe:Y_sv:Zr | ? | m319 | - |
| info | *quench | - | 0.2119 | -0.0619 | - | - | 100 | 20:70:5:5 | B:Fe:Y_sv:Zr | ? | m319 | - |