| 选择 | ID | 化学式 | 原始文件名 | 数据集 | 标记摘要 | AutoNEP | NEP_300K | SCREEN |
|---|---|---|---|---|---|---|---|---|
| 9894 | Li4 P4 Pd2 O14 | mp-616572.cif | mp-Li | - | - | - |
ML:0.001737 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.7815 Å
3D:4.345
Li 位点:5.324
|
|
| 9893 | Li8 V4 P4 O24 | mp-616566.cif | mp-Li | - | - | - |
ML:2.233e-06 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.5455 Å
3D:1.596
Li 位点:3.852
|
|
| 9892 | Na12 Li12 V8 F48 | mp-6153.cif | mp-Li | - | - | - |
ML:3.654e-05 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 9891 | Li4 Nb4 Zn4 O16 | mp-6146.cif | mp-Li | - | - | - |
ML:3.651e-09 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.586 Å
3D:1.748
Li 位点:1.859
|
|
| 9890 | Li2 Ca2 Al2 F12 | mp-6134.cif | mp-Li | - | - | - |
ML:2.309e-05 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 9889 | Li3 Cd3 B3 O9 | mp-6126.cif | mp-Li | - | - | - |
ML:1.373e-07 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.655 Å
3D:1.408
Li 位点:1.482
|
|
| 9888 | Li4 Ti4 As4 O20 | mp-6113.cif | mp-Li | - | - | - |
ML:6.279e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.606 Å
3D:1.498
Li 位点:2.191
|
|
| 9887 | Li4 Sc4 Si8 O24 | mp-6099.cif | mp-Li | - | - | - |
ML:0.001128 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.5805 Å
3D:1.592
Li 位点:4.053
|
|
| 9886 | Li6 Al2 B4 O12 | mp-6097.cif | mp-Li | - | - | - |
ML:2.506e-05 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.657 Å
3D:1.245
Li 位点:3.57
|
|
| 9885 | Cs2 Li3 I5 | mp-608311.cif | mp-Li | - | 0.002869 S/cm | 2.28 mS/cm |
ML:0.01694 mS/cm
AutoNEP:0.002869 S/cm
NEP_300K:2.28 mS/cm
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 9884 | Cs6 Na2 Li4 B4 O12 | mp-607931.cif | mp-Li | - | - | - |
ML:0.0929 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.5165 Å
3D:2.011
Li 位点:1.356
|
|
| 9883 | Rb12 Li2 Nd22 Se24 Cl32 O72 | mp-607785.cif | mp-Li | - | - | - |
ML:0.5167 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 9882 | Ba4 Li2 B10 O20 | mp-6075.cif | mp-Li | - | - | - |
ML:0.001935 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.6535 Å
3D:2.273
Li 位点:5.705
|
|
| 9881 | Sr6 Li2 Ir2 O12 | mp-6071.cif | mp-Li | - | - | - |
ML:5.039e-05 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 9880 | Cs3 Li1 Cl4 | mp-606711.cif | mp-Li | - | 1.321e-04 S/cm | 0.03147 mS/cm |
ML:0.006751 mS/cm
AutoNEP:1.321e-04 S/cm
NEP_300K:0.03147 mS/cm
GII:-
3D 阈值:-
状态:未通过
半径:1.038 Å
3D:4.224
Li 位点:2.815
|
|
| 9879 | Cs1 Li2 Br3 | mp-606680.cif | mp-Li | beta-B | 0.006473 S/cm | 5.762 mS/cm |
ML:0.09221 mS/cm
AutoNEP:0.006473 S/cm
NEP_300K:5.762 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.5695 Å
3D:2.219
Li 位点:4.355
|
|
| 9878 | Cs1 Li2 F3 | mp-606604.cif | mp-Li | - | - | - |
ML:3.346e-06 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 9877 | Ba16 Li8 N8 | mp-605860.cif | mp-Li | - | - | - |
ML:0.1002 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 9876 | Li4 C1 O4 | mp-605853.cif | mp-Li | - | - | - |
ML:1.472e-06 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 9875 | Li4 B4 Rh6 | mp-605839.cif | mp-Li | - | - | - |
ML:0.002208 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 9874 | Li8 H64 C16 S16 N8 O40 | mp-605006.cif | mp-Li | - | - | - |
ML:0.04138 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 9873 | Li4 B12 H72 N20 | mp-604486.cif | mp-Li | - | 1.097e-05 S/cm | 7.453e-05 mS/cm |
ML:6.169e-04 mS/cm
AutoNEP:1.097e-05 S/cm
NEP_300K:7.453e-05 mS/cm
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 9872 | Li16 B32 H32 O72 | mp-604459.cif | mp-Li | - | - | - |
ML:0.00169 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 9871 | Li4 Al4 Si4 H8 O20 | mp-604430.cif | mp-Li | - | - | - |
ML:0.005263 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 9870 | Li4 Al4 Si4 H8 O20 | mp-604420.cif | mp-Li | - | - | - |
ML:0.002169 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 9869 | Na8 Li4 H24 N12 | mp-604147.cif | mp-Li | - | 9.495e-04 S/cm | 1.349e-08 mS/cm |
ML:0.001233 mS/cm
AutoNEP:9.495e-04 S/cm
NEP_300K:1.349e-08 mS/cm
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 9868 | Li4 Fe6 P8 O28 | mp-603606.cif | mp-Li | - | - | - |
ML:5.814e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.732 Å
3D:1.317
Li 位点:7.373
|
|
| 9867 | Li16 Nb2 N8 O1 | mp-6031.cif | mp-Li | - | - | - |
ML:0.02437 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.742 Å
3D:7.573
Li 位点:1.753
|
|
| 9866 | Li4 Si4 N4 O4 | mp-6015.cif | mp-Li | - | - | - |
ML:4.497e-10 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.602 Å
3D:1.633
Li 位点:1.478
|
|
| 9865 | Li4 Zr12 H72 N16 F76 | mp-601344.cif | mp-Li | - | 1.092e-07 S/cm | 4.464e-04 mS/cm |
ML:0.7705 mS/cm
AutoNEP:1.092e-07 S/cm
NEP_300K:4.464e-04 mS/cm
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 9864 | Ba16 Li4 Mo8 N28 | mp-6011.cif | mp-Li | - | - | - |
ML:0.01184 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 9863 | Cs2 Li2 B12 O20 | mp-5990.cif | mp-Li | - | - | - |
ML:4.202e-06 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:1.046 Å
3D:1.733
Li 位点:5.823
|
|
| 9862 | Li1 Al1 Ge1 | mp-5920.cif | mp-Li | - | - | - |
ML:0.01026 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 9861 | Li12 B4 N8 | mp-5914.cif | mp-Li | - | - | - |
ML:6.737e-07 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 9860 | Li12 Fe20 O32 | mp-586092.cif | mp-Li | - | - | - |
ML:4.229e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.5075 Å
3D:1.657
Li 位点:2.137
|
|
| 9859 | Li6 Sn4 P6 O24 | mp-585408.cif | mp-Li | - | - | - |
ML:0.005866 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.8485 Å
3D:2.02
Li 位点:5.936
|
|
| 9858 | Li6 Fe6 P6 O24 | mp-585400.cif | mp-Li | - | - | - |
ML:3.343e-05 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:1.165 Å
3D:1.668
Li 位点:3.112
|
|
| 9857 | Li4 Ga4 O8 | mp-5854.cif | mp-Li | - | - | - |
ML:4.094e-09 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.5825 Å
3D:1.799
Li 位点:1.421
|
|
| 9856 | Li2 Cr4 P6 O20 | mp-585354.cif | mp-Li | - | - | - |
ML:0.002672 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.7215 Å
3D:1.387
Li 位点:4.429
|
|
| 9855 | Li2 Cu4 P10 O32 | mp-585339.cif | mp-Li | - | - | - |
ML:0.001958 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:1.175 Å
3D:1.568
Li 位点:5.225
|
|
| 9854 | Li9 Mn9 P12 O48 | mp-585338.cif | mp-Li | - | - | - |
ML:0.002956 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.5945 Å
3D:2.3
Li 位点:8.262
|
|
| 9853 | Li2 Mo8 P14 O48 | mp-585332.cif | mp-Li | 势函数可信 | 0.00166 S/cm | 0.5245 mS/cm |
ML:0.006505 mS/cm
AutoNEP:0.00166 S/cm
NEP_300K:0.5245 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.7775 Å
3D:1.834
Li 位点:5.932
|
|
| 9852 | Li16 Fe16 P16 O64 | mp-585319.cif | mp-Li | - | - | - |
ML:1.183e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.7325 Å
3D:1.69
Li 位点:6.705
|
|
| 9851 | Li18 Bi6 P16 O58 | mp-585305.cif | mp-Li | - | - | - |
ML:9.945e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:1.03 Å
3D:1.46
Li 位点:4.574
|
|
| 9850 | Li2 Si4 N6 | mp-5853.cif | mp-Li | - | - | - |
ML:2.271e-08 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 9849 | Li16 Mn16 P16 O64 | mp-585279.cif | mp-Li | - | - | - |
ML:3.430e-05 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.7115 Å
3D:1.486
Li 位点:4.413
|
|
| 9848 | Li10 Mo4 P10 O36 | mp-585269.cif | mp-Li | - | - | - |
ML:0.00281 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.6445 Å
3D:1.481
Li 位点:3.693
|
|
| 9847 | Li2 Mo4 P6 O24 | mp-585265.cif | mp-Li | - | - | - |
ML:0.01201 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.8 Å
3D:1.759
Li 位点:7.662
|
|
| 9846 | Li1 Mo4 P4 O22 | mp-585261.cif | mp-Li | - | - | - |
ML:0.004804 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.958 Å
3D:1.43
Li 位点:3.196
|
|
| 9845 | Li2 Mn8 P6 O24 | mp-585250.cif | mp-Li | - | - | - |
ML:0.008991 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.649 Å
3D:2.14
Li 位点:4.436
|