|
fig# |
type |
psymbol |
dE[eV/at] |
dH[eV/at] |
drb |
dri |
nat |
nn_spec |
ch_spec |
stab |
encut |
ext |
| info | 2 | B11Mg5Ru13 | oP116 | STABLE | -0.3548 | 0.01 | 0.10 | 116 | 44:20:52 | B:Mg:Ru | LT | m319 | - |
| info | 11 | B4Mg2Ru5 | oP22 | STABLE | -0.3513 | - | 0.04 | 22 | 8:4:10 | B:Mg:Ru | LT | m319 | - |
| info | 36 | *d-B4Mg2Ru5 | *B2H2x2.L3 | 0.0003 | -0.3544 | - | - | 116 | 44:20:52 | B:Mg:Ru | ? | m319 | - |
| info | 38 | *d-B4Mg2Ru5 | *B2H2x2.L5 | 0.0023 | -0.3524 | - | - | 116 | 44:20:52 | B:Mg:Ru | ? | m319 | - |
| info | 64 | *d-B4Mg2Ru5 | *B3H2x2.s2 | 0.0026 | -0.3516 | - | - | 152 | 58:26:68 | B:Mg:Ru | ? | m319 | - |
| info | 65 | *d-B4Mg2Ru5 | *B3H2x2.s3 | 0.0029 | -0.3513 | - | - | 152 | 58:26:68 | B:Mg:Ru | ? | m319 | - |
| info | 63 | *d-B4Mg2Ru5 | *B3H2x2.s1 | 0.0030 | -0.3512 | - | - | 152 | 58:26:68 | B:Mg:Ru | ? | m319 | - |
| info | 39 | *d-B4Mg2Ru5 | *B2H2x2.L6 | 0.0031 | -0.3516 | - | - | 116 | 44:20:52 | B:Mg:Ru | ? | m319 | - |
| info | 52 | *d-B4Mg2Ru5 | *B2Hx2.new | 0.0033 | -0.3506 | - | - | 94 | 36:16:42 | B:Mg:Ru | ? | m319 | - |
| info | 70 | *d-B4Mg2Ru5 | *B5H3x2.L9337 | 0.0036 | -0.3505 | - | - | 246 | 94:42:110 | B:Mg:Ru | ? | m319 | - |
| info | 29 | *d-B4Mg2Ru5 | *B2H2bx2.L7 | 0.0040 | -0.3508 | - | - | 116 | 44:20:52 | B:Mg:Ru | ? | m319 | - |
| info | 26 | *d-B4Mg2Ru5 | *B2H2bx2.L4 | 0.0042 | -0.3505 | - | - | 116 | 44:20:52 | B:Mg:Ru | ? | m319 | - |
| info | 34 | *d-B4Mg2Ru5 | *B2H2-mono | 0.0042 | -0.3505 | - | - | 58 | 22:10:26 | B:Mg:Ru | ? | m319 | - |
| info | 35 | *d-B4Mg2Ru5 | *B2H2x2.L2 | 0.0043 | -0.3504 | - | - | 116 | 44:20:52 | B:Mg:Ru | ? | m319 | - |
| info | 80 | *d-B4Mg2Ru5 | *HEx2.2sf | 0.0044 | -0.3480 | - | - | 72 | 28:12:32 | B:Mg:Ru | ? | m319 | - |
| info | 54 | *d-B4Mg2Ru5 | *B2ux2.2sf | 0.0045 | -0.3479 | - | - | 72 | 28:12:32 | B:Mg:Ru | ? | m319 | - |
| info | 30 | *d-B4Mg2Ru5 | *B2H2bx2.L8 | 0.0046 | -0.3502 | - | - | 116 | 44:20:52 | B:Mg:Ru | ? | m319 | - |
| info | 74 | *d-B4Mg2Ru5 | *BH2x2.sf | 0.0046 | -0.3492 | - | - | 80 | 30:14:36 | B:Mg:Ru | ? | m319 | - |
| info | 40 | *d-B4Mg2Ru5 | *B2H2x3.1sf | 0.0053 | -0.3494 | - | - | 174 | 66:30:78 | B:Mg:Ru | ? | m319 | - |
| info | 24 | *d-B4Mg2Ru5 | *B2H2bx2.L2 | 0.0056 | -0.3491 | - | - | 116 | 44:20:52 | B:Mg:Ru | ? | m319 | - |
| info | 69 | *d-B4Mg2Ru5 | *B5H3b.3sf | 0.0060 | -0.3480 | - | - | 246 | 94:42:110 | B:Mg:Ru | ? | m319 | - |
| info | 77 | *d-B4Mg2Ru5 | *BHx2.1sf | 0.0064 | -0.3483 | - | - | 58 | 22:10:26 | B:Mg:Ru | ? | m319 | - |
| info | 66 | *d-B4Mg2Ru5 | *B3H2x2.s4 | 0.0071 | -0.3471 | - | - | 152 | 58:26:68 | B:Mg:Ru | ? | m319 | - |
| info | 76 | *d-B4Mg2Ru5 | *BH-altx2.sf | 0.0081 | -0.3467 | - | - | 58 | 22:10:26 | B:Mg:Ru | ? | m319 | - |
| info | 73 | *d-B4Mg2Ru5 | *BH2 | 0.0083 | -0.3455 | - | - | 40 | 15:7:18 | B:Mg:Ru | ? | m319 | - |
| info | 31 | *d-B4Mg2Ru5 | *B2H2.M1 | 0.0084 | -0.3463 | - | - | 58 | 22:10:26 | B:Mg:Ru | ? | m319 | - |
| info | 27 | *d-B4Mg2Ru5 | *B2H2bx2.L5 | 0.0085 | -0.3462 | - | - | 116 | 44:20:52 | B:Mg:Ru | ? | m319 | - |
| info | 61 | *d-B4Mg2Ru5 | *B3H2x2.3sf | 0.0087 | -0.3455 | - | - | 152 | 58:26:68 | B:Mg:Ru | ? | m319 | - |
| info | 48 | *d-B4Mg2Ru5 | *B2Hx2.L3 | 0.0087 | -0.3451 | - | - | 94 | 36:16:42 | B:Mg:Ru | ? | m319 | - |
| info | 45 | *d-B4Mg2Ru5 | *B2H.M3 | 0.0089 | -0.3450 | - | - | 47 | 18:8:21 | B:Mg:Ru | ? | m319 | - |
| info | 32 | *d-B4Mg2Ru5 | *B2H2.M2 | 0.0090 | -0.3458 | - | - | 58 | 22:10:26 | B:Mg:Ru | ? | m319 | - |
| info | 68 | *d-B4Mg2Ru5 | *B5H3-alt | 0.0095 | -0.3445 | - | - | 123 | 47:21:55 | B:Mg:Ru | ? | m319 | - |
| info | 49 | *d-B4Mg2Ru5 | *B2Hx2.L4 | 0.0095 | -0.3443 | - | - | 94 | 36:16:42 | B:Mg:Ru | ? | m319 | - |
| info | 37 | *d-B4Mg2Ru5 | *B2H2x2.L4 | 0.0098 | -0.3449 | - | - | 116 | 44:20:52 | B:Mg:Ru | ? | m319 | - |
| info | 25 | *d-B4Mg2Ru5 | *B2H2bx2.L3 | 0.0101 | -0.3447 | - | - | 116 | 44:20:52 | B:Mg:Ru | ? | m319 | - |
| info | 56 | *d-B4Mg2Ru5 | *B3H2b | 0.0104 | -0.3437 | - | - | 76 | 29:13:34 | B:Mg:Ru | ? | m319 | - |
| info | 3 | B11Mg5Ru13 | oP62 | 0.0105 | -0.3442 | 0.17 | 0.26 | 58 | 22:10:26 | B:Mg:Ru | ? | m319 | - |
| info | 55 | *d-B4Mg2Ru5 | *B3H2 | 0.0105 | -0.3437 | - | - | 76 | 29:13:34 | B:Mg:Ru | ? | m319 | - |
| info | 50 | *d-B4Mg2Ru5 | *B2Hx2.L5 | 0.0107 | -0.3432 | - | - | 94 | 36:16:42 | B:Mg:Ru | ? | m319 | - |
| info | 16 | *d-B4Mg2Ru5 | *B1 | 0.0108 | -0.3416 | - | - | 18 | 7:3:8 | B:Mg:Ru | ? | m319 | - |
| info | 53 | *d-B4Mg2Ru5 | *B2u | 0.0109 | -0.3415 | - | - | 36 | 14:6:16 | B:Mg:Ru | ? | m319 | - |
| info | 20 | *d-B4Mg2Ru5 | *B2H2b.M3 | 0.0109 | -0.3439 | - | - | 58 | 22:10:26 | B:Mg:Ru | ? | m319 | - |
| info | 71 | *d-B4Mg2Ru5 | *B6H4 | 0.0112 | -0.3430 | - | - | 152 | 58:26:68 | B:Mg:Ru | ? | m319 | - |
| info | 57 | *d-B4Mg2Ru5 | *B3H2c | 0.0113 | -0.3429 | - | - | 76 | 29:13:34 | B:Mg:Ru | ? | m319 | - |
| info | 18 | *d-B4Mg2Ru5 | *B2H2b.M1 | 0.0116 | -0.3431 | - | - | 58 | 22:10:26 | B:Mg:Ru | ? | m319 | - |
| info | 72 | *d-B4Mg2Ru5 | *BH | 0.0117 | -0.3431 | - | - | 29 | 11:5:13 | B:Mg:Ru | ? | m319 | - |
| info | 62 | *d-B4Mg2Ru5 | *B3H2x2b.3sf | 0.0120 | -0.3422 | - | - | 152 | 58:26:68 | B:Mg:Ru | ? | m319 | - |
| info | 28 | *d-B4Mg2Ru5 | *B2H2bx2.L6 | 0.0120 | -0.3427 | - | - | 116 | 44:20:52 | B:Mg:Ru | ? | m319 | - |
| info | 19 | *d-B4Mg2Ru5 | *B2H2b.M2 | 0.0123 | -0.3425 | - | - | 58 | 22:10:26 | B:Mg:Ru | ? | m319 | - |
| info | 41 | *d-B4Mg2Ru5 | *B2Hb | 0.0129 | -0.3409 | - | - | 47 | 18:8:21 | B:Mg:Ru | ? | m319 | - |
| info | 59 | *d-B4Mg2Ru5 | *B3H2e | 0.0132 | -0.3410 | - | - | 76 | 29:13:34 | B:Mg:Ru | ? | m319 | - |
| info | 21 | *d-B4Mg2Ru5 | *B2H2b.M4 | 0.0139 | -0.3409 | - | - | 58 | 22:10:26 | B:Mg:Ru | ? | m319 | - |
| info | 81 | MgOs3B4 | oC32 | 0.0141 | -0.3025 | - | 0.09 | 16 | 8:2:6 | B:Mg:Ru | ? | m319 | - |
| info | 75 | *d-B4Mg2Ru5 | *BH-alt | 0.0142 | -0.3405 | - | - | 29 | 11:5:13 | B:Mg:Ru | ? | m319 | - |
| info | 23 | *d-B4Mg2Ru5 | *B2H2bx2.L1 | 0.0142 | -0.3406 | - | - | 116 | 44:20:52 | B:Mg:Ru | ? | m319 | - |
| info | 60 | *d-B4Mg2Ru5 | *B3H2f | 0.0144 | -0.3398 | - | - | 76 | 29:13:34 | B:Mg:Ru | ? | m319 | - |
| info | 58 | *d-B4Mg2Ru5 | *B3H2d | 0.0147 | -0.3395 | - | - | 76 | 29:13:34 | B:Mg:Ru | ? | m319 | - |
| info | 67 | *d-B4Mg2Ru5 | *B4H4.M2 | 0.0152 | -0.3396 | - | - | 116 | 44:20:52 | B:Mg:Ru | ? | m319 | - |
| info | 43 | *d-B4Mg2Ru5 | *B2H.M1 | 0.0156 | -0.3383 | - | - | 47 | 18:8:21 | B:Mg:Ru | ? | m319 | - |
| info | 47 | *d-B4Mg2Ru5 | *B2Hx2.L2 | 0.0164 | -0.3375 | - | - | 94 | 36:16:42 | B:Mg:Ru | ? | m319 | - |
| info | 42 | *d-B4Mg2Ru5 | *B2H-bx2.L8 | 0.0168 | -0.3370 | - | - | 94 | 36:16:42 | B:Mg:Ru | ? | m319 | - |
| info | 17 | *d-B4Mg2Ru5 | *B2 | 0.0180 | -0.3344 | - | - | 36 | 14:6:16 | B:Mg:Ru | ? | m319 | - |
| info | 33 | *d-B4Mg2Ru5 | *B2H2.M3 | 0.0182 | -0.3365 | - | - | 58 | 22:10:26 | B:Mg:Ru | ? | m319 | - |
| info | 51 | *d-B4Mg2Ru5 | *B2Hx2.L6 | 0.0182 | -0.3357 | - | - | 94 | 36:16:42 | B:Mg:Ru | ? | m319 | - |
| info | 46 | *d-B4Mg2Ru5 | *B2Hx2.L1 | 0.0191 | -0.3348 | - | - | 94 | 36:16:42 | B:Mg:Ru | ? | m319 | - |
| info | 7 | B4CrY | oP24 | 0.0203 | -0.2078 | - | 0.18 | 24 | 16:4:4 | B:Mg:Ru | ? | m319 | - |
| info | 22 | *d-B4Mg2Ru5 | *B2H2b.M5 | 0.0246 | -0.3301 | - | - | 58 | 22:10:26 | B:Mg:Ru | ? | m319 | - |
| info | 79 | *d-B4Mg2Ru5 | *HE | 0.0249 | -0.3275 | - | - | 36 | 14:6:16 | B:Mg:Ru | ? | m319 | - |
| info | 78 | *d-B4Mg2Ru5 | *H1 | 0.0253 | -0.3261 | - | - | 11 | 4:2:5 | B:Mg:Ru | ? | m319 | - |
| info | 44 | *d-B4Mg2Ru5 | *B2H.M2 | 0.0311 | -0.3228 | - | - | 47 | 18:8:21 | B:Mg:Ru | ? | m319 | - |
| info | 13 | B7ReY3 | oC44 | 0.0317 | -0.1677 | - | 0.17 | 22 | 14:6:2 | B:Mg:Ru | ? | m319 | - |
| info | 9 | B4LuRu4 | tI72 | 0.0811 | -0.2583 | - | 0.13 | 36 | 16:4:16 | B:Mg:Ru | ? | m319 | - |
| info | 6 | B4CeCo4 | tP18 | 0.1400 | -0.1995 | - | 0.10 | 18 | 8:2:8 | B:Mg:Ru | ? | m319 | - |
| info | 14 | C6Cr23 | cF116 | 0.1587 | -0.0412 | - | 0.05 | 29 | 6:3:20 | B:Mg:Ru | ? | m319 | - |
| info | 1 | Al4Ba | tI10 | 0.1893 | -0.1423 | - | 0.19 | 5 | 2:1:2 | B:Mg:Ru | ? | m319 | - |
| info | 15 | CaCu5 | hP6 | 0.1899 | -0.1322 | - | - | 6 | 2:1:3 | B:Mg:Ru | ? | m319 | - |
| info | 10 | B4Mg2Ni5 | hP18 | 0.2185 | -0.1036 | - | 0.06 | 18 | 6:3:9 | B:Mg:Ru | ? | m319 | - |
| info | 12 | B6Co3Tb4 | hR13 | 0.2282 | -0.0195 | - | 0.23 | 13 | 6:4:3 | B:Mg:Ru | ? | m319 | - |
| info | 5 | B2Co5Ti3 | tP20 | 0.3940 | 0.1457 | - | 0.11 | 20 | 4:6:10 | B:Mg:Ru | ? | m319 | - |
| info | 4 | B2Co5Ti3 | tP20 | 0.4017 | 0.1809 | - | 0.09 | 20 | 4:4:12 | B:Mg:Ru | ? | m319 | - |
| info | 8 | B4La2Ni5 | mC22 | 0.4289 | 0.0775 | - | 0.23 | 11 | 4:2:5 | B:Mg:Ru | ? | m319 | - |
 |