| 选择 | ID | 化学式 | 原始文件名 | 数据集 | 标记摘要 | AutoNEP | NEP_300K | SCREEN |
|---|---|---|---|---|---|---|---|---|
| 21242 | Li8 Te4 O16 | ICSD-1_CollCode1485.cif | default | - | 1.083e-07 S/cm | 9.678e-06 mS/cm |
ML:-
AutoNEP:1.083e-07 S/cm
NEP_300K:9.678e-06 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.731 Å
3D:1.417
Li 位点:6.892
|
|
| 21241 | Li8 W4 O16 | ICSD-1_CollCode14196.cif | default | - | 6.444e-13 S/cm | 1.110e-05 mS/cm |
ML:-
AutoNEP:6.444e-13 S/cm
NEP_300K:1.110e-05 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.511 Å
3D:1.704
Li 位点:3.046
|
|
| 21240 | Li16 Pb4 O16 | ICSD-1_CollCode1411.cif | default | - | 5.893e-08 S/cm | 5.236e-06 mS/cm |
ML:-
AutoNEP:5.893e-08 S/cm
NEP_300K:5.236e-06 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.69 Å
3D:1.817
Li 位点:2.7
|
|
| 21239 | Li2 P6 Pb2 O18 | ICSD-1_CollCode1123.cif | default | - | 4.466e-05 S/cm | 3.646e-08 mS/cm |
ML:-
AutoNEP:4.466e-05 S/cm
NEP_300K:3.646e-08 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.721 Å
3D:1.67
Li 位点:6.372
|
|
| 21238 | Li32 W16 O64 | ICSD-1_CollCode10479.cif | default | - | 4.046e-12 S/cm | 2.221e-07 mS/cm |
ML:-
AutoNEP:4.046e-12 S/cm
NEP_300K:2.221e-07 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.6485 Å
3D:1.823
Li 位点:7.242
|
|
| 21237 | Li32 W16 O64 | ICSD-1_CollCode1045.cif | default | - | 3.835e-18 S/cm | 6.325e-08 mS/cm |
ML:-
AutoNEP:3.835e-18 S/cm
NEP_300K:6.325e-08 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.666 Å
3D:1.922
Li 位点:7.225
|
|
| 21236 | Li8 W4 O16 | ICSD-1_CollCode1044.cif | default | - | 2.906e-17 S/cm | 3.692e-05 mS/cm |
ML:-
AutoNEP:2.906e-17 S/cm
NEP_300K:3.692e-05 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.5335 Å
3D:1.819
Li 位点:2.948
|
|
| 21235 | Li2 Al2 Si8 O20 | ICSD-1_CollCode100348.cif | default | - | 3.546 S/cm | 9.718e-06 mS/cm |
ML:-
AutoNEP:3.546 S/cm
NEP_300K:9.718e-06 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.9735 Å
3D:1.408
Li 位点:8.342
|
|
| 21234 | Li2 Sn2 Cl6 | mp-998591.cif | mp-Li | - | 0.05797 S/cm | 2.347 mS/cm |
ML:0.003507 mS/cm
AutoNEP:0.05797 S/cm
NEP_300K:2.347 mS/cm
GII:-
3D 阈值:-
状态:未通过
半径:0.63 Å
3D:1.467
Li 位点:1.786
|
|
| 21233 | Li1 Sn1 Cl3 | mp-998230.cif | mp-Li | 势函数不精确 | 0.06408 S/cm | 0.2049 mS/cm |
ML:0.008191 mS/cm
AutoNEP:0.06408 S/cm
NEP_300K:0.2049 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.671 Å
3D:1.769
Li 位点:2.134
|
|
| 21232 | Li2 Co6 O12 | mp-997539.cif | mp-Li | - | - | - |
ML:6.728e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.6645 Å
3D:3.759
Li 位点:4.785
|
|
| 21231 | Li6 V6 P12 H12 O48 | mp-997534.cif | mp-Li | - | - | - |
ML:0.01324 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 21230 | Li2 Fe16 O24 | mp-997515.cif | mp-Li | - | - | - |
ML:4.060e-10 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.542 Å
3D:1.715
Li 位点:1.838
|
|
| 21229 | Li2 Ag2 O4 | mp-996997.cif | mp-Li | - | - | - |
ML:3.975e-15 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.749 Å
3D:1.663
Li 位点:-
|
|
| 21228 | Li1 Ag1 O2 | mp-996992.cif | mp-Li | - | - | - |
ML:4.190e-09 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.599 Å
3D:0.9828
Li 位点:2.204
|
|
| 21227 | Li2 Ag2 O4 | mp-996989.cif | mp-Li | - | - | - |
ML:1.954e-09 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.706 Å
3D:1.317
Li 位点:2.983
|
|
| 21226 | Li1 Ag1 O2 | mp-996988.cif | mp-Li | - | - | - |
ML:2.623e-08 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.793 Å
3D:2.095
Li 位点:-
|
|
| 21225 | Li2 Cu2 O4 | mp-996987.cif | mp-Li | - | - | - |
ML:3.134e-07 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.6115 Å
3D:1.512
Li 位点:2.004
|
|
| 21224 | Li2 Cu2 O4 | mp-996986.cif | mp-Li | - | - | - |
ML:0.003759 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.7485 Å
3D:1.44
Li 位点:1.969
|
|
| 21223 | Li2 Ag2 O4 | mp-996962.cif | mp-Li | - | - | - |
ML:3.793e-09 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.611 Å
3D:1.623
Li 位点:-
|
|
| 21222 | Li2 Au2 O4 | mp-996961.cif | mp-Li | - | - | - |
ML:4.361e-07 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:1.083 Å
3D:3.249
Li 位点:1.56
|
|
| 21221 | Li2 Au2 O4 | mp-996959.cif | mp-Li | - | - | - |
ML:1.254e-05 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.762 Å
3D:1.602
Li 位点:1.446
|
|
| 21220 | Li4 Al4 B16 | mp-995282.cif | mp-Li | - | - | - |
ML:0.003525 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 21219 | Ba1 Li1 Si1 | mp-9950.cif | mp-Li | - | - | - |
ML:0.001661 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 21218 | Li2 Zn2 Sb2 | mp-9919.cif | mp-Li | - | - | - |
ML:0.06676 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 21217 | Li2 Be2 P2 | mp-9915.cif | mp-Li | - | - | - |
ML:2.546e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 21216 | Li2 Ce1 P2 | mp-9912.cif | mp-Li | - | - | - |
ML:0.0233 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 21215 | Rb2 Li1 In1 Cl6 | mp-989583.cif | mp-Li | - | - | - |
ML:0.1243 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 21214 | Rb2 Li1 Tl1 Cl6 | mp-989579.cif | mp-Li | - | 0.001628 S/cm | - |
ML:0.4163 mS/cm
AutoNEP:0.001628 S/cm
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.4675 Å
3D:2.273
Li 位点:1.868
|
|
| 21213 | Li1 Tl2 Ga1 F6 | mp-989577.cif | mp-Li | - | - | - |
ML:1.971e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 21212 | Cs2 Li1 Tl1 F6 | mp-989562.cif | mp-Li | - | - | - |
ML:0.2747 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 21211 | Cs2 Na1 Li1 F6 | mp-989559.cif | mp-Li | - | - | - |
ML:8.706e-05 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 21210 | Li1 Tl2 In1 F6 | mp-989551.cif | mp-Li | - | - | - |
ML:0.07668 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 21209 | Cs2 Li1 N1 F6 | mp-989536.cif | mp-Li | - | 3.036e-05 S/cm | 0.06706 mS/cm |
ML:8.480e-04 mS/cm
AutoNEP:3.036e-05 S/cm
NEP_300K:0.06706 mS/cm
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 21208 | Li1 Tl2 In1 Cl6 | mp-989512.cif | mp-Li | - | 7.172e-08 S/cm | - |
ML:0.2068 mS/cm
AutoNEP:7.172e-08 S/cm
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.5755 Å
3D:4.448
Li 位点:2.504
|
|
| 21207 | Na2 Li1 N1 F6 | mp-989504.cif | mp-Li | - | - | - |
ML:4.215e-05 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 21206 | Cs2 Li1 In1 Br6 | mp-989405.cif | mp-Li | beta-B | 9.183e-14 S/cm | 1.192e-07 mS/cm |
ML:0.2271 mS/cm
AutoNEP:9.183e-14 S/cm
NEP_300K:1.192e-07 mS/cm
GII:-
3D 阈值:-
状态:未通过
半径:0.4595 Å
3D:3.917
Li 位点:1.997
|
|
| 21205 | Li8 Si16 O28 | mp-985637.cif | mp-Li | - | - | - |
ML:1.914e-05 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.859 Å
3D:1.576
Li 位点:4.147
|
|
| 21204 | Li6 P1 S5 Cl1 | mp-985592.cif | mp-Li | - | - | - |
ML:0.02059 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 21203 | Li6 P1 S5 Br1 | mp-985591.cif | mp-Li | - | - | - |
ML:0.1947 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 21202 | Li3 Cl1 O1 | mp-985585.cif | mp-Li | - | 0.1159 S/cm | - |
ML:1.079e-07 mS/cm
AutoNEP:0.1159 S/cm
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.485 Å
3D:1.817
Li 位点:2.676
|
|
| 21201 | Li12 P4 S16 | mp-985583.cif | mp-Li | - | - | - |
ML:4.009e-05 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.6075 Å
3D:2.441
Li 位点:2.884
|
|
| 21200 | Li6 P1 S5 I1 | mp-985582.cif | mp-Li | - | - | - |
ML:0.05222 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 21199 | Li2 Ag2 C4 O8 | mp-985575.cif | mp-Li | - | - | - |
ML:3.394e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 21198 | Li2 Ag2 C4 O8 | mp-985572.cif | mp-Li | - | - | - |
ML:2.312e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 21197 | Li2 Ag2 C4 O8 | mp-985571.cif | mp-Li | - | - | - |
ML:5.862e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 21196 | Li8 Er8 Sn8 | mp-984635.cif | mp-Li | - | - | - |
ML:0.003766 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 21195 | K2 Li1 Al1 F6 | mp-9839.cif | mp-Li | - | - | - |
ML:2.148e-05 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 21194 | Li2 Pm1 Ga1 | mp-983460.cif | mp-Li | - | - | - |
ML:2.509e-10 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 21193 | Li1 Pm1 Zn2 | mp-983444.cif | mp-Li | - | - | - |
ML:2.218e-05 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|