| 选择 | ID | 化学式 | 原始文件名 | 数据集 | 标记摘要 | AutoNEP | NEP_300K | SCREEN |
|---|---|---|---|---|---|---|---|---|
| 21406 | Li55 Ca3 La21 Zr14 W2 O96 | Li6.9La2.6Ca0.4Zr1.75W0.25O12.cif | test | - | 6.088e-04 S/cm | 0.303 mS/cm |
ML:0.3349 mS/cm
AutoNEP:6.088e-04 S/cm
NEP_300K:0.303 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.5445 Å
3D:1.754
Li 位点:2.378
|
|
| 21405 | Li51 La24 Zr16 Ge1 O96 | Li6.6Ge0.10La3Zr2O12.cif | test | - | 0.003435 S/cm | 0.8071 mS/cm |
ML:0.3755 mS/cm
AutoNEP:0.003435 S/cm
NEP_300K:0.8071 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.5375 Å
3D:1.832
Li 位点:2.38
|
|
| 21404 | Li51 La24 Zr12 Ta4 O96 | Li6.5La3Zr1.5Ta0.5O12.cif | test | - | - | - |
ML:0.364 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:-
半径:-
3D:-
Li 位点:-
|
|
| 21403 | Li51 La24 Ta4 Sn12 O96 | Li6.5La3Sn1.5Ta0.5O12.cif | test | - | 0.001667 S/cm | 0.3441 mS/cm |
ML:0.01594 mS/cm
AutoNEP:0.001667 S/cm
NEP_300K:0.3441 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.503 Å
3D:1.832
Li 位点:2.318
|
|
| 21402 | Li51 La24 Zr16 Al1 Ga1 O96 | Li6.4Al0.05Ga0.15La3Zr2O12.cif | test | - | 0.001356 S/cm | 0.1386 mS/cm |
ML:0.5188 mS/cm
AutoNEP:0.001356 S/cm
NEP_300K:0.1386 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.5365 Å
3D:1.749
Li 位点:2.406
|
|
| 21401 | Li50 La24 Zr16 Al2 O96 | Li6.25Al0.25La3Zr2O12.cif | test | - | 2.630e-04 S/cm | 0.4661 mS/cm |
ML:0.28 mS/cm
AutoNEP:2.630e-04 S/cm
NEP_300K:0.4661 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.538 Å
3D:1.72
Li 位点:2.371
|
|
| 21400 | Li40 La24 Bi16 O96 | Li5La3Bi2O12.cif | test | - | - | - |
ML:0.01929 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:-
半径:-
3D:-
Li 位点:-
|
|
| 21399 | Li22 P4 S19 Cl5 | Li5.5PS4.5Cl1.5.cif | test | - | 0.01898 S/cm | 6.159 mS/cm |
ML:0.168 mS/cm
AutoNEP:0.01898 S/cm
NEP_300K:6.159 mS/cm
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 21398 | Li18 Y6 Cl36 | Li3YCl6.cif | test | - | 0.1573 S/cm | 20.68 mS/cm |
ML:0.07134 mS/cm
AutoNEP:0.1573 S/cm
NEP_300K:20.68 mS/cm
GII:-
3D 阈值:-
状态:未通过
半径:0.4795 Å
3D:2.222
Li 位点:2.083
|
|
| 21397 | Li6 Y2 Br12 | Li3YBr6.cif | test | - | 0.1264 S/cm | 50.16 mS/cm |
ML:0.3616 mS/cm
AutoNEP:0.1264 S/cm
NEP_300K:50.16 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.5085 Å
3D:2.412
Li 位点:2.105
|
|
| 21396 | Li4 In2 Cl11 | Li3InCl6__2.cif | test | - | 2.777 S/cm | 28.67 mS/cm |
ML:0.2126 mS/cm
AutoNEP:2.777 S/cm
NEP_300K:28.67 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.6065 Å
3D:2.095
Li 位点:2.376
|
|
| 21395 | Li6 In2 Cl12 | Li3InCl6.cif | test | - | 0.01058 S/cm | 78.53 mS/cm |
ML:0.141 mS/cm
AutoNEP:0.01058 S/cm
NEP_300K:78.53 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.509 Å
3D:2.175
Li 位点:2.123
|
|
| 21394 | Li3 La4 Ti6 O20 | Li1.8La2Ti2.8Nb0.2O10.cif | test | - | 7.752e-07 S/cm | 9.390e-04 mS/cm |
ML:1.086e-06 mS/cm
AutoNEP:7.752e-07 S/cm
NEP_300K:9.390e-04 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.702 Å
3D:1.202
Li 位点:5.473
|
|
| 21393 | Li8 Ti10 Al2 P18 O72 | Li1.3Al0.3Ti1.7(PO4)3.cif | test | - | 1.197e-04 S/cm | 3.448 mS/cm |
ML:1.241 mS/cm
AutoNEP:1.197e-04 S/cm
NEP_300K:3.448 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.737 Å
3D:2.23
Li 位点:13.28
|
|
| 21392 | Li7 Sc1 Ti11 P18 O72 | Li1.2Ti1.8Sc0.2(PO4)3.cif | test | - | 0.002982 S/cm | 8.34 mS/cm |
ML:0.8926 mS/cm
AutoNEP:0.002982 S/cm
NEP_300K:8.34 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.6745 Å
3D:2.27
Li 位点:4.789
|
|
| 21391 | Li24 Gd4 B12 O36 | ICSD-1_CollCode96123.cif | default | - | - | - |
ML:-
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.777 Å
3D:1.614
Li 位点:6.311
|
|
| 21390 | Li4 Er4 O8 | ICSD-1_CollCode95381.cif | default | - | - | - |
ML:-
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.7555 Å
3D:1.425
Li 位点:-
|
|
| 21389 | Ba6 Li6 B54 O90 | ICSD-1_CollCode95115.cif | default | - | 6.225e-05 S/cm | 3.145e-04 mS/cm |
ML:-
AutoNEP:6.225e-05 S/cm
NEP_300K:3.145e-04 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:1.075 Å
3D:1.652
Li 位点:2.549
|
|
| 21388 | Li8 Zr4 O12 | ICSD-1_CollCode94897.cif | default | - | 3.970e-09 S/cm | 2.869e-06 mS/cm |
ML:-
AutoNEP:3.970e-09 S/cm
NEP_300K:2.869e-06 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.569 Å
3D:1.788
Li 位点:2.357
|
|
| 21387 | Li8 Zr4 O12 | ICSD-1_CollCode94896.cif | default | - | - | - |
ML:-
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.565 Å
3D:1.787
Li 位点:2.325
|
|
| 21386 | Li8 Zr4 O12 | ICSD-1_CollCode94895.cif | default | - | - | - |
ML:-
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.561 Å
3D:1.787
Li 位点:2.315
|
|
| 21385 | Li8 Zr4 O12 | ICSD-1_CollCode94894.cif | default | - | 1.623e-06 S/cm | 2.369e-05 mS/cm |
ML:-
AutoNEP:1.623e-06 S/cm
NEP_300K:2.369e-05 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.5615 Å
3D:1.786
Li 位点:2.305
|
|
| 21384 | Li8 Zr4 O12 | ICSD-1_CollCode94893.cif | default | - | 2.425e-10 S/cm | 2.550e-05 mS/cm |
ML:-
AutoNEP:2.425e-10 S/cm
NEP_300K:2.550e-05 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.533 Å
3D:1.821
Li 位点:2.252
|
|
| 21383 | Li12 In4 B8 O24 | ICSD-1_CollCode94355.cif | default | - | 7.048e-05 S/cm | 1.292e-05 mS/cm |
ML:-
AutoNEP:7.048e-05 S/cm
NEP_300K:1.292e-05 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.589 Å
3D:1.682
Li 位点:2.81
|
|
| 21382 | Ba6 Li6 B54 O90 | ICSD-1_CollCode93013.cif | default | - | 0.004127 S/cm | 0.2029 mS/cm |
ML:-
AutoNEP:0.004127 S/cm
NEP_300K:0.2029 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:1.085 Å
3D:1.671
Li 位点:2.517
|
|
| 21381 | Li18 Al18 Si18 O72 | ICSD-1_CollCode92708.cif | default | - | - | - |
ML:-
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:1.127 Å
3D:1.714
Li 位点:6.098
|
|
| 21380 | Li2 Sc2 P4 O14 | ICSD-1_CollCode91496.cif | default | - | 6.079e-08 S/cm | 2.282e-07 mS/cm |
ML:-
AutoNEP:6.079e-08 S/cm
NEP_300K:2.282e-07 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.8185 Å
3D:1.355
Li 位点:6.546
|
|
| 21379 | Li4 Zr8 P12 O48 | ICSD-1_CollCode91112.cif | default | - | 1.354e-08 S/cm | 4.066e-08 mS/cm |
ML:-
AutoNEP:1.354e-08 S/cm
NEP_300K:4.066e-08 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.831 Å
3D:1.599
Li 位点:10.8
|
|
| 21378 | Li8 Si16 B8 O48 | ICSD-1_CollCode90849.cif | default | - | - | - |
ML:-
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.75 Å
3D:1.308
Li 位点:11.28
|
|
| 21377 | Li8 Zn4 Si4 O16 | ICSD-1_CollCode8237.cif | default | - | - | - |
ML:-
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.621 Å
3D:1.514
Li 位点:2.626
|
|
| 21376 | Li8 Bi8 O24 | ICSD-1_CollCode82277.cif | default | - | 1.223 S/cm | 0.05457 mS/cm |
ML:-
AutoNEP:1.223 S/cm
NEP_300K:0.05457 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.508 Å
3D:1.61
Li 位点:5.162
|
|
| 21375 | Li4 Zn4 P4 O16 | ICSD-1_CollCode79352.cif | default | - | 1.713e-18 S/cm | 6.442e-07 mS/cm |
ML:-
AutoNEP:1.713e-18 S/cm
NEP_300K:6.442e-07 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.686 Å
3D:2.143
Li 位点:2.823
|
|
| 21374 | Cs2 Na6 Li24 Ge8 O32 | ICSD-1_CollCode79098.cif | default | - | 0.01112 S/cm | 0.006152 mS/cm |
ML:-
AutoNEP:0.01112 S/cm
NEP_300K:0.006152 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.65 Å
3D:1.477
Li 位点:3.182
|
|
| 21373 | Li40 Si8 Pb4 O40 | ICSD-1_CollCode78326.cif | default | - | 3.638e-06 S/cm | - |
ML:-
AutoNEP:3.638e-06 S/cm
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.631 Å
3D:1.691
Li 位点:4.334
|
|
| 21372 | Li4 Al4 P16 O48 | ICSD-1_CollCode74860.cif | default | - | 0.0066 S/cm | 0.01752 mS/cm |
ML:-
AutoNEP:0.0066 S/cm
NEP_300K:0.01752 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.752 Å
3D:1.812
Li 位点:9.53
|
|
| 21371 | K3 Li18 Ta3 O18 | ICSD-1_CollCode73159.cif | default | - | 3.133e-05 S/cm | 0.2927 mS/cm |
ML:-
AutoNEP:3.133e-05 S/cm
NEP_300K:0.2927 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.5925 Å
3D:1.668
Li 位点:2.337
|
|
| 21370 | K2 Li8 Nb2 O10 | ICSD-1_CollCode73124.cif | default | - | 4.084e-04 S/cm | 1.104e-04 mS/cm |
ML:-
AutoNEP:4.084e-04 S/cm
NEP_300K:1.104e-04 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.642 Å
3D:1.936
Li 位点:4.205
|
|
| 21369 | K1 Li6 Bi1 O6 | ICSD-1_CollCode72840.cif | default | - | 3.101e-13 S/cm | 0.1158 mS/cm |
ML:-
AutoNEP:3.101e-13 S/cm
NEP_300K:0.1158 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.6215 Å
3D:1.654
Li 位点:2.441
|
|
| 21368 | Li12 Al4 Ge4 O20 | ICSD-1_CollCode72099.cif | default | - | 5.656e-08 S/cm | 6.204e-05 mS/cm |
ML:-
AutoNEP:5.656e-08 S/cm
NEP_300K:6.204e-05 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.6365 Å
3D:1.815
Li 位点:3.763
|
|
| 21367 | Li12 Al4 Ge4 O20 | ICSD-1_CollCode72098.cif | default | - | 2.054e+04 S/cm | 4.330e-05 mS/cm |
ML:-
AutoNEP:2.054e+04 S/cm
NEP_300K:4.330e-05 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.6145 Å
3D:1.788
Li 位点:2.382
|
|
| 21366 | K3 Li18 Bi3 O18 | ICSD-1_CollCode71035.cif | default | - | 0.003205 S/cm | 0.5592 mS/cm |
ML:-
AutoNEP:0.003205 S/cm
NEP_300K:0.5592 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.6145 Å
3D:1.689
Li 位点:2.382
|
|
| 21365 | Li24 Y4 B12 O36 | ICSD-1_CollCode68653.cif | default | - | 0.002064 S/cm | 4.928e-04 mS/cm |
ML:-
AutoNEP:0.002064 S/cm
NEP_300K:4.928e-04 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.634 Å
3D:1.723
Li 位点:4.836
|
|
| 21364 | Li2 Ge2 B2 O8 | ICSD-1_CollCode67535.cif | default | - | 2.458e-15 S/cm | 5.958e-06 mS/cm |
ML:-
AutoNEP:2.458e-15 S/cm
NEP_300K:5.958e-06 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.6315 Å
3D:1.122
Li 位点:3.606
|
|
| 21363 | Li36 W18 O72 | ICSD-1_CollCode67236.cif | default | - | - | - |
ML:-
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:1.368 Å
3D:1.986
Li 位点:2.781
|
|
| 21362 | Li4 Al4 Si4 O16 | ICSD-1_CollCode66137.cif | default | - | 8.494e-05 S/cm | 0.001688 mS/cm |
ML:-
AutoNEP:8.494e-05 S/cm
NEP_300K:0.001688 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.6855 Å
3D:1.561
Li 位点:4.991
|
|
| 21361 | Li32 Zn32 P32 O128 | ICSD-1_CollCode65764.cif | default | - | 1.342e-12 S/cm | 3.113e-06 mS/cm |
ML:-
AutoNEP:1.342e-12 S/cm
NEP_300K:3.113e-06 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.628 Å
3D:1.444
Li 位点:6.233
|
|
| 21360 | K4 Li28 Zr6 O28 | ICSD-1_CollCode65445.cif | default | - | 1.939e-12 S/cm | 0.07705 mS/cm |
ML:-
AutoNEP:1.939e-12 S/cm
NEP_300K:0.07705 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.5975 Å
3D:1.667
Li 位点:4.853
|
|
| 21359 | Cs4 Li28 Tb6 O28 | ICSD-1_CollCode65444.cif | default | - | - | - |
ML:-
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.6085 Å
3D:2.037
Li 位点:5.745
|
|
| 21358 | K8 Li32 Al8 O32 | ICSD-1_CollCode65260.cif | default | - | 9.883e-05 S/cm | 0.03929 mS/cm |
ML:-
AutoNEP:9.883e-05 S/cm
NEP_300K:0.03929 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.5995 Å
3D:1.92
Li 位点:3.112
|
|
| 21357 | Li2 Al2 Si8 O20 | ICSD-1_CollCode64962.cif | default | - | 2.341e-05 S/cm | 0.007755 mS/cm |
ML:-
AutoNEP:2.341e-05 S/cm
NEP_300K:0.007755 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.9585 Å
3D:1.437
Li 位点:8.51
|