| 选择 | ID | 化学式 | 原始文件名 | 数据集 | 标记摘要 | AutoNEP | NEP_300K | SCREEN |
|---|---|---|---|---|---|---|---|---|
| 8894 | Li3 B3 Pt9 | mp-28613.cif | mp-Li | - | - | - |
ML:0.00449 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8893 | Na4 Li12 Si24 | mp-28612.cif | mp-Li | - | - | - |
ML:0.008379 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8892 | Li4 Mn4 O8 | mp-2861076.cif | mp-Li | - | - | - |
ML:4.875e-07 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.563 Å
3D:1.571
Li 位点:1.99
|
|
| 8891 | Na4 Li4 Se4 | mp-28603.cif | mp-Li | - | 3.060e-14 S/cm | 3.373e-05 mS/cm |
ML:0.02541 mS/cm
AutoNEP:3.060e-14 S/cm
NEP_300K:3.373e-05 mS/cm
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8890 | Li3 Br1 O1 | mp-28593.cif | mp-Li | - | - | - |
ML:0.00101 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8889 | Li7 Br3 O2 | mp-28592.cif | mp-Li | - | - | - |
ML:0.008312 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.452 Å
3D:13.03
Li 位点:2.554
|
|
| 8888 | Li2 Bi2 F8 | mp-28567.cif | mp-Li | - | - | - |
ML:0.005447 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8887 | Li16 Si2 O12 | mp-28549.cif | mp-Li | - | - | - |
ML:1.462e-07 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.691 Å
3D:1.873
Li 位点:4.75
|
|
| 8886 | Li16 Ge2 O12 | mp-28548.cif | mp-Li | - | - | - |
ML:3.433e-05 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.6865 Å
3D:1.925
Li 位点:2.803
|
|
| 8885 | Rb4 Li4 O4 | mp-28545.cif | mp-Li | - | - | - |
ML:2.118e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8884 | Li4 Ta6 N10 | mp-28523.cif | mp-Li | - | - | - |
ML:1.149e-05 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8883 | Li24 Bi8 O24 | mp-28510.cif | mp-Li | - | - | - |
ML:6.603e-06 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.7715 Å
3D:1.9
Li 位点:7.492
|
|
| 8882 | Li12 As4 S12 | mp-28471.cif | mp-Li | - | - | - |
ML:0.01341 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.634 Å
3D:1.984
Li 位点:3.501
|
|
| 8881 | Li4 Nb12 Cl32 | mp-28463.cif | mp-Li | beta-D | 4.753e-12 S/cm | - |
ML:0.1799 mS/cm
AutoNEP:4.753e-12 S/cm
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.562 Å
3D:1.915
Li 位点:6.264
|
|
| 8880 | Li8 P4 O14 | mp-28450.cif | mp-Li | - | - | - |
ML:2.876e-09 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.6795 Å
3D:1.961
Li 位点:6.297
|
|
| 8879 | Li4 Ga4 Cl16 | mp-28341.cif | mp-Li | - | 0.002515 S/cm | - |
ML:0.07093 mS/cm
AutoNEP:0.002515 S/cm
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.5455 Å
3D:2.232
Li 位点:2.694
|
|
| 8878 | Li4 Ga4 Br12 | mp-28327.cif | mp-Li | beta-B、势函数可信 | 0.02862 S/cm | 10.22 mS/cm |
ML:0.1331 mS/cm
AutoNEP:0.02862 S/cm
NEP_300K:10.22 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.548 Å
3D:2.082
Li 位点:3.394
|
|
| 8877 | Li4 Ga4 Br16 | mp-28326.cif | mp-Li | beta-B、势函数可信 | 5.416e+10 S/cm | 0.09285 mS/cm |
ML:0.1974 mS/cm
AutoNEP:5.416e+10 S/cm
NEP_300K:0.09285 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.5295 Å
3D:2.398
Li 位点:2.474
|
|
| 8876 | K12 Li4 Si16 | mp-28316.cif | mp-Li | - | - | - |
ML:0.02955 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8875 | Li2 Ru2 O4 | mp-28254.cif | mp-Li | - | - | - |
ML:6.641e-10 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8874 | Li4 Bi4 O8 | mp-28253.cif | mp-Li | - | - | - |
ML:1.012e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.9325 Å
3D:2.448
Li 位点:5.061
|
|
| 8873 | Li2 Mn1 Br4 | mp-28250.cif | mp-Li | beta-B | - | - |
ML:0.06316 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.4825 Å
3D:2.363
Li 位点:2.005
|
|
| 8872 | Rb2 Li2 Cl4 | mp-28243.cif | mp-Li | - | 9.895e-05 S/cm | 0.09722 mS/cm |
ML:2.096e-05 mS/cm
AutoNEP:9.895e-05 S/cm
NEP_300K:0.09722 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.6145 Å
3D:1.991
Li 位点:4.219
|
|
| 8871 | Rb2 Li2 Br4 | mp-28237.cif | mp-Li | beta-B | 1.355e-04 S/cm | 2.293e-07 mS/cm |
ML:0.03618 mS/cm
AutoNEP:1.355e-04 S/cm
NEP_300K:2.293e-07 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.6075 Å
3D:2.057
Li 位点:4.534
|
|
| 8870 | Li4 Ga20 O32 | mp-28146.cif | mp-Li | - | - | - |
ML:7.803e-09 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8869 | Li2 Gd2 Cl8 | mp-28122.cif | mp-Li | beta-D | 0.004529 S/cm | - |
ML:0.02749 mS/cm
AutoNEP:0.004529 S/cm
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.467 Å
3D:2.077
Li 位点:3.551
|
|
| 8868 | Li2 Dy4 Cl10 | mp-28068.cif | mp-Li | beta-D | - | - |
ML:0.00581 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.5125 Å
3D:5.062
Li 位点:2.674
|
|
| 8867 | Li6 Ge6 Te12 | mp-28060.cif | mp-Li | - | - | - |
ML:0.3397 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8866 | Li32 Nb8 O36 | mp-28030.cif | mp-Li | - | - | - |
ML:3.956e-05 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.5155 Å
3D:1.974
Li 位点:1.967
|
|
| 8865 | Li4 Ge9 O20 | mp-28016.cif | mp-Li | - | - | - |
ML:1.395e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.703 Å
3D:1.759
Li 位点:7.381
|
|
| 8864 | Li24 Ge8 O28 | mp-27968.cif | mp-Li | - | - | - |
ML:2.429e-07 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.6515 Å
3D:1.778
Li 位点:6.994
|
|
| 8863 | Li16 Co2 O12 | mp-27920.cif | mp-Li | - | - | - |
ML:6.515e-06 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.682 Å
3D:1.947
Li 位点:2.817
|
|
| 8862 | Li8 Te8 O20 | mp-27811.cif | mp-Li | - | - | - |
ML:2.498e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.9495 Å
3D:1.77
Li 位点:3.873
|
|
| 8861 | Li4 H4 Rh1 | mp-27797.cif | mp-Li | - | - | - |
ML:6.976e-07 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8860 | Li8 H10 Rh2 | mp-27796.cif | mp-Li | - | 4.708e-06 S/cm | - |
ML:4.817e-06 mS/cm
AutoNEP:4.708e-06 S/cm
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8859 | Li12 Si4 O14 | mp-27767.cif | mp-Li | - | - | - |
ML:5.867e-09 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.804 Å
3D:1.481
Li 位点:7.095
|
|
| 8858 | Li12 Th4 F28 | mp-27761.cif | mp-Li | - | - | - |
ML:0.008272 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8857 | Li2 V6 O15 | mp-27751.cif | mp-Li | - | - | - |
ML:0.00214 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.6685 Å
3D:2.226
Li 位点:4.505
|
|
| 8856 | Li1 Sn1 S2 | mp-27683.cif | mp-Li | - | - | - |
ML:0.006046 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8855 | Li4 Al4 H16 | mp-27653.cif | mp-Li | - | - | - |
ML:2.094e-07 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8854 | Li6 Br3 N1 | mp-27508.cif | mp-Li | - | 0.00132 S/cm | 0.03397 mS/cm |
ML:0.001757 mS/cm
AutoNEP:0.00132 S/cm
NEP_300K:0.03397 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.5785 Å
3D:1.599
Li 位点:3.506
|
|
| 8853 | Li2 V6 O16 | mp-27503.cif | mp-Li | - | - | - |
ML:8.757e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.5735 Å
3D:1.797
Li 位点:4.541
|
|
| 8852 | Li2 Th1 N2 | mp-27487.cif | mp-Li | - | - | - |
ML:5.173e-05 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8851 | Li40 Tl8 O32 | mp-27483.cif | mp-Li | - | - | - |
ML:6.461e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.651 Å
3D:1.667
Li 位点:1.509
|
|
| 8850 | Ba2 Li4 Si2 | mp-27454.cif | mp-Li | - | - | - |
ML:1.386e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8849 | Li7 Sb1 O6 | mp-27453.cif | mp-Li | - | - | - |
ML:1.879e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.609 Å
3D:2.474
Li 位点:4.186
|
|
| 8848 | Li1 Bi1 F6 | mp-27419.cif | mp-Li | - | - | - |
ML:2.652e-05 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8847 | Li12 In4 O12 | mp-27417.cif | mp-Li | - | - | - |
ML:4.313e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.547 Å
3D:1.9
Li 位点:1.854
|
|
| 8846 | Li8 U8 F40 | mp-27403.cif | mp-Li | - | - | - |
ML:2.616e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8845 | Na1 Li5 Sn4 | mp-27368.cif | mp-Li | - | - | - |
ML:0.001773 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|