| 选择 | ID | 化学式 | 原始文件名 | 数据集 | 标记摘要 | AutoNEP | NEP_300K | SCREEN |
|---|---|---|---|---|---|---|---|---|
| 10194 | Cs2 Li1 Mn1 C6 N6 | mp-6854.cif | mp-Li | - | - | - |
ML:0.1599 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 10193 | Li17 W19 O57 | mp-685395.cif | mp-Li | - | - | - |
ML:0.001075 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.7135 Å
3D:3.759
Li 位点:1.686
|
|
| 10192 | Li20 B54 O1 | mp-685320.cif | mp-Li | - | - | - |
ML:0.01426 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:1.82 Å
3D:1.998
Li 位点:10.58
|
|
| 10191 | Li21 Mn33 O72 | mp-685293.cif | mp-Li | - | - | - |
ML:3.601e-05 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.647 Å
3D:5.294
Li 位点:4.991
|
|
| 10190 | Li20 Co21 O40 | mp-685270.cif | mp-Li | - | - | - |
ML:2.287e-06 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.5315 Å
3D:2.366
Li 位点:1.761
|
|
| 10189 | Li6 Mg42 N30 | mp-685266.cif | mp-Li | - | - | - |
ML:1.255e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 10188 | Li1 Mn16 O32 | mp-685250.cif | mp-Li | - | - | - |
ML:1.716e-06 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.638 Å
3D:2.596
Li 位点:3.388
|
|
| 10187 | Li6 Mn20 O40 | mp-685233.cif | mp-Li | - | - | - |
ML:6.376e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.783 Å
3D:7.546
Li 位点:4.692
|
|
| 10186 | Li8 Ti10 O24 | mp-685194.cif | mp-Li | - | - | - |
ML:2.816e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.6045 Å
3D:1.74
Li 位点:1.984
|
|
| 10185 | K2 Li1 Ta6 P3 O24 | mp-684817.cif | mp-Li | - | - | - |
ML:0.08675 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.812 Å
3D:2.51
Li 位点:4.335
|
|
| 10184 | Li4 Fe2 P4 H2 O16 | mp-684770.cif | mp-Li | - | - | - |
ML:0.02207 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 10183 | Li2 Al2 Si4 H4 O14 | mp-684746.cif | mp-Li | - | - | - |
ML:0.001505 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 10182 | Li12 Sb8 P12 O48 | mp-684539.cif | mp-Li | - | - | - |
ML:0.001306 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.7355 Å
3D:1.616
Li 位点:7.406
|
|
| 10181 | Li4 Nb4 P16 O52 | mp-684534.cif | mp-Li | - | 6.188e-14 S/cm | 9.026e-04 mS/cm |
ML:0.01383 mS/cm
AutoNEP:6.188e-14 S/cm
NEP_300K:9.026e-04 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.9345 Å
3D:1.569
Li 位点:5.143
|
|
| 10180 | Li4 Sn4 P12 O36 | mp-684509.cif | mp-Li | - | - | - |
ML:0.008055 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.714 Å
3D:1.398
Li 位点:5.247
|
|
| 10179 | Li4 Sb8 P12 O48 | mp-684508.cif | mp-Li | - | - | - |
ML:1.843e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.8475 Å
3D:1.538
Li 位点:10.8
|
|
| 10178 | Li4 Bi4 P16 O48 | mp-684506.cif | mp-Li | - | - | - |
ML:0.007765 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.903 Å
3D:1.91
Li 位点:4.6
|
|
| 10177 | Li12 Bi8 P12 O48 | mp-684504.cif | mp-Li | - | - | - |
ML:1.523e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.7565 Å
3D:1.819
Li 位点:5.758
|
|
| 10176 | Li4 Sn4 P12 O36 | mp-684503.cif | mp-Li | - | - | - |
ML:3.017e-05 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.659 Å
3D:1.455
Li 位点:6.485
|
|
| 10175 | Li4 Bi4 P16 O48 | mp-684497.cif | mp-Li | - | - | - |
ML:0.01636 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.826 Å
3D:1.582
Li 位点:8.922
|
|
| 10174 | Li4 Sn8 P12 O40 | mp-684493.cif | mp-Li | - | - | - |
ML:0.003993 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.9195 Å
3D:1.72
Li 位点:4.321
|
|
| 10173 | Li4 Bi4 P8 O28 | mp-684489.cif | mp-Li | - | - | - |
ML:0.00491 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.728 Å
3D:1.595
Li 位点:6.835
|
|
| 10172 | Li4 Sb2 P10 O30 | mp-684477.cif | mp-Li | - | - | - |
ML:0.005713 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:1.006 Å
3D:1.787
Li 位点:8.28
|
|
| 10171 | Li6 Sn4 P10 O32 | mp-684470.cif | mp-Li | - | - | - |
ML:0.02606 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:1.252 Å
3D:1.686
Li 位点:8.173
|
|
| 10170 | Li6 Bi6 P16 O58 | mp-684454.cif | mp-Li | - | - | - |
ML:0.05674 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:1.056 Å
3D:1.697
Li 位点:8.945
|
|
| 10169 | Li4 Sn4 P8 O28 | mp-684446.cif | mp-Li | - | - | - |
ML:5.336e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.838 Å
3D:1.759
Li 位点:6.07
|
|
| 10168 | Li4 Sb4 P16 O48 | mp-684427.cif | mp-Li | - | - | - |
ML:0.001116 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.78 Å
3D:1.518
Li 位点:8.618
|
|
| 10167 | K2 Li6 Si24 Sn4 O60 | mp-6844.cif | mp-Li | - | - | - |
ML:0.03022 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.948 Å
3D:1.714
Li 位点:4.736
|
|
| 10166 | Li4 Cu4 P8 O28 | mp-684120.cif | mp-Li | - | - | - |
ML:0.003783 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.6685 Å
3D:1.925
Li 位点:3.913
|
|
| 10165 | Li4 Ti4 P20 O60 | mp-684119.cif | mp-Li | - | - | - |
ML:0.001281 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.9765 Å
3D:1.544
Li 位点:7.755
|
|
| 10164 | Li4 Bi4 P8 O28 | mp-684109.cif | mp-Li | - | - | - |
ML:0.002145 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.6815 Å
3D:1.48
Li 位点:3.564
|
|
| 10163 | Li4 Ti2 P10 O30 | mp-684108.cif | mp-Li | - | - | - |
ML:0.001008 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.8735 Å
3D:1.735
Li 位点:6.32
|
|
| 10162 | Li4 Sb4 P8 O28 | mp-684106.cif | mp-Li | - | - | - |
ML:0.00529 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.7285 Å
3D:1.553
Li 位点:7.527
|
|
| 10161 | Li2 Sb4 P10 O32 | mp-684104.cif | mp-Li | - | - | - |
ML:0.006765 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:1.312 Å
3D:1.658
Li 位点:5.993
|
|
| 10160 | Li4 Bi4 P16 O48 | mp-684093.cif | mp-Li | - | - | - |
ML:0.02174 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:1.124 Å
3D:1.862
Li 位点:5.124
|
|
| 10159 | Li4 Sb4 P8 O28 | mp-684090.cif | mp-Li | - | - | - |
ML:0.008044 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.6325 Å
3D:1.723
Li 位点:6.257
|
|
| 10158 | Li2 Sb2 P8 O24 | mp-684082.cif | mp-Li | - | - | - |
ML:0.00287 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:1.454 Å
3D:1.828
Li 位点:6.499
|
|
| 10157 | Li4 Ti2 P10 O30 | mp-684066.cif | mp-Li | - | - | - |
ML:2.274e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.881 Å
3D:1.854
Li 位点:7.916
|
|
| 10156 | Li2 Ti2 P10 O30 | mp-684059.cif | mp-Li | - | 1.291e-07 S/cm | 0.05948 mS/cm |
ML:0.007287 mS/cm
AutoNEP:1.291e-07 S/cm
NEP_300K:0.05948 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.8985 Å
3D:1.778
Li 位点:7.987
|
|
| 10155 | Li2 Sn12 P14 O48 | mp-684052.cif | mp-Li | - | - | - |
ML:0.02272 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.7235 Å
3D:1.728
Li 位点:2.438
|
|
| 10154 | Li6 Bi4 P6 O24 | mp-684042.cif | mp-Li | - | - | - |
ML:0.003203 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.816 Å
3D:2.088
Li 位点:7.799
|
|
| 10153 | Li9 Bi3 P6 O24 | mp-684028.cif | mp-Li | - | - | - |
ML:3.979e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.6655 Å
3D:1.654
Li 位点:6.018
|
|
| 10152 | Li64 Si32 N64 | mp-684024.cif | mp-Li | - | - | - |
ML:4.260e-05 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 10151 | Na8 Li4 Fe4 Si24 O60 | mp-6838.cif | mp-Li | - | - | - |
ML:0.03084 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.618 Å
3D:1.725
Li 位点:4.685
|
|
| 10150 | Li5 Ti7 In1 P12 O48 | mp-683616.cif | mp-Li | beta-D、zsc-0909、势函数可信 | 0.00634 S/cm | 10.96 mS/cm |
ML:0.8743 mS/cm
AutoNEP:0.00634 S/cm
NEP_300K:10.96 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.7325 Å
3D:1.983
Li 位点:10.9
|
|
| 10149 | Li2 Zr4 P6 O24 | mp-681439.cif | mp-Li | - | 9.739e-05 S/cm | 0.02414 mS/cm |
ML:0.03919 mS/cm
AutoNEP:9.739e-05 S/cm
NEP_300K:0.02414 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.9865 Å
3D:1.645
Li 位点:7.945
|
|
| 10148 | K32 Li16 Sn64 | mp-680450.cif | mp-Li | - | - | - |
ML:0.03525 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 10147 | Rb16 Li8 Sn32 | mp-680436.cif | mp-Li | - | - | - |
ML:0.04677 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 10146 | Li2 Mo12 Cl26 | mp-680167.cif | mp-Li | - | - | - |
ML:0.1664 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.643 Å
3D:2.353
Li 位点:5.966
|
|
| 10145 | K2 Li2 S2 O8 | mp-6800.cif | mp-Li | - | - | - |
ML:7.338e-06 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|