| 选择 | ID | 化学式 | 原始文件名 | 数据集 | 标记摘要 | AutoNEP | NEP_300K | SCREEN |
|---|---|---|---|---|---|---|---|---|
| 8262 | Li5 Cr1 Cl8 | mp-23361.cif | mp-Li | - | - | - |
ML:0.003436 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.5105 Å
3D:2.216
Li 位点:2.302
|
|
| 8261 | Li10 B14 Cl2 O25 | mp-23122.cif | mp-Li | - | - | - |
ML:8.250e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.5295 Å
3D:5.143
Li 位点:2.815
|
|
| 8260 | Cs2 Li2 Br4 | mp-23057.cif | mp-Li | beta-B、势函数待更新 | 4.323e-06 S/cm | 5.015 mS/cm |
ML:0.2476 mS/cm
AutoNEP:4.323e-06 S/cm
NEP_300K:5.015 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.655 Å
3D:2.072
Li 位点:2.664
|
|
| 8259 | Li4 I4 O12 | mp-22994.cif | mp-Li | - | - | - |
ML:5.485e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.516 Å
3D:2.043
Li 位点:3.239
|
|
| 8258 | Li4 Al4 Cl16 | mp-22983.cif | mp-Li | - | 0.1251 S/cm | - |
ML:0.008386 mS/cm
AutoNEP:0.1251 S/cm
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.5575 Å
3D:2.208
Li 位点:2.691
|
|
| 8257 | Li2 Co1 Cl4 | mp-22980.cif | mp-Li | - | - | - |
ML:0.001447 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.525 Å
3D:2.103
Li 位点:2.02
|
|
| 8256 | Li2 Fe1 Br4 | mp-22967.cif | mp-Li | beta-B | 1.027e-07 S/cm | 1.362e-07 mS/cm |
ML:0.04201 mS/cm
AutoNEP:1.027e-07 S/cm
NEP_300K:1.362e-07 mS/cm
GII:-
3D 阈值:-
状态:未通过
半径:0.5415 Å
3D:2.356
Li 位点:2.082
|
|
| 8255 | Li4 Zn2 Cl8 | mp-22961.cif | mp-Li | - | 0.04965 S/cm | 0.05445 mS/cm |
ML:0.003668 mS/cm
AutoNEP:0.04965 S/cm
NEP_300K:0.05445 mS/cm
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8254 | Li2 I2 O6 | mp-22955.cif | mp-Li | - | - | - |
ML:5.196e-05 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8253 | Li1 In1 Mo3 O8 | mp-22805.cif | mp-Li | - | - | - |
ML:8.717e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.506 Å
3D:1.817
Li 位点:1.805
|
|
| 8252 | Li2 Cu4 P2 | mp-22716.cif | mp-Li | - | - | - |
ML:0.00854 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8251 | Li8 P8 Pb8 O32 | mp-22694.cif | mp-Li | - | - | - |
ML:0.00392 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.653 Å
3D:1.463
Li 位点:3.465
|
|
| 8250 | Rb4 Li2 Fe2 F12 | mp-22663.cif | mp-Li | - | - | - |
ML:0.01012 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8249 | Li6 Mn12 O24 | mp-22584.cif | mp-Li | - | - | - |
ML:5.969e-07 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.551 Å
3D:1.751
Li 位点:1.724
|
|
| 8248 | Li8 Pb1 O6 | mp-22538.cif | mp-Li | - | - | - |
ML:2.460e-05 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.59 Å
3D:2.402
Li 位点:1.991
|
|
| 8247 | Li1 Co1 O2 | mp-22526.cif | mp-Li | - | - | - |
ML:1.167e-08 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8246 | Li4 Pb2 O6 | mp-22450.cif | mp-Li | - | - | - |
ML:2.604e-07 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.557 Å
3D:1.816
Li 位点:2.047
|
|
| 8245 | Li4 Pr2 Sb4 | mp-22446.cif | mp-Li | - | - | - |
ML:0.03428 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8244 | Li4 Mo2 F12 | mp-22439.cif | mp-Li | - | - | - |
ML:3.203e-05 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8243 | Li4 Ni4 P4 O16 | mp-22417.cif | mp-Li | - | - | - |
ML:1.225e-05 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.6095 Å
3D:2.094
Li 位点:1.851
|
|
| 8242 | Li4 Ni4 As4 O16 | mp-22243.cif | mp-Li | - | - | - |
ML:1.554e-06 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.6185 Å
3D:1.947
Li 位点:2.027
|
|
| 8241 | Li3 Mn3 Fe3 F18 | mp-22200.cif | mp-Li | - | - | - |
ML:1.880e-05 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8240 | Li2 Fe2 Ge4 O12 | mp-22173.cif | mp-Li | - | - | - |
ML:3.712e-05 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.5115 Å
3D:1.648
Li 位点:2.991
|
|
| 8239 | Li8 Pb2 O8 | mp-22170.cif | mp-Li | - | - | - |
ML:4.155e-06 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.6575 Å
3D:1.827
Li 位点:5.143
|
|
| 8238 | Li2 Co4 P6 O20 | mp-22042.cif | mp-Li | - | - | - |
ML:0.001211 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.7505 Å
3D:1.375
Li 位点:4.269
|
|
| 8237 | Na12 Li12 Co8 F48 | mp-21932.cif | mp-Li | - | - | - |
ML:1.463e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8236 | Li2 Sn8 Ir2 | mp-21894.cif | mp-Li | - | - | - |
ML:0.03441 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8235 | Li8 Fe8 Mo12 O48 | mp-21778.cif | mp-Li | - | - | - |
ML:0.004288 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.9395 Å
3D:1.706
Li 位点:2.561
|
|
| 8234 | Li4 Fe20 O32 | mp-21735.cif | mp-Li | beta-A | 9.199e-09 S/cm | 6.256e-05 mS/cm |
ML:2.815e-07 mS/cm
AutoNEP:9.199e-09 S/cm
NEP_300K:6.256e-05 mS/cm
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8233 | Li8 Ni4 Ge12 O32 | mp-21650.cif | mp-Li | - | - | - |
ML:4.183e-05 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.575 Å
3D:1.627
Li 位点:1.99
|
|
| 8232 | Li18 V6 F36 | mp-21633.cif | mp-Li | - | - | - |
ML:8.903e-05 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8231 | Li4 Cr4 Ge8 O24 | mp-21549.cif | mp-Li | - | - | - |
ML:2.758e-05 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.545 Å
3D:1.703
Li 位点:2.988
|
|
| 8230 | Li18 Ti6 F36 | mp-21540.cif | mp-Li | - | - | - |
ML:1.904e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8229 | Li1 La4 Cu1 O8 | mp-21496.cif | mp-Li | - | - | - |
ML:0.001209 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8228 | Li2 Fe2 As2 | mp-21471.cif | mp-Li | - | - | - |
ML:0.003782 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8227 | Li4 Gd4 O8 | mp-21332.cif | mp-Li | - | - | - |
ML:0.0117 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.752 Å
3D:1.807
Li 位点:1.512
|
|
| 8226 | Li2 Sn8 Ru2 | mp-21297.cif | mp-Li | - | - | - |
ML:0.001135 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8225 | Li2 Mn2 As2 | mp-21284.cif | mp-Li | - | - | - |
ML:0.002958 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8224 | Li4 Fe4 Ge8 O24 | mp-21270.cif | mp-Li | - | - | - |
ML:5.024e-05 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.55 Å
3D:1.69
Li 位点:2.991
|
|
| 8223 | Li2 In1 Pd1 | mp-21029.cif | mp-Li | - | - | - |
ML:2.986e-05 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8222 | Li2 In1 Pt1 | mp-21026.cif | mp-Li | - | - | - |
ML:4.424e-05 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8221 | Cs2 Li1 Fe1 C6 N6 | mp-21013.cif | mp-Li | - | - | - |
ML:0.1328 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8220 | Li3 Ca3 Pb3 | mp-20998.cif | mp-Li | - | - | - |
ML:0.01368 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8219 | Cs2 Li1 Cr1 C6 N6 | mp-20988.cif | mp-Li | - | - | - |
ML:0.14 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8218 | Li1 In2 Pd1 | mp-20801.cif | mp-Li | - | - | - |
ML:5.587e-07 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8217 | Li2 In2 Te4 | mp-20782.cif | mp-Li | - | 5.002e-09 S/cm | - |
ML:3.212e-05 mS/cm
AutoNEP:5.002e-09 S/cm
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8216 | Li4 Ce2 Sb4 | mp-20779.cif | mp-Li | - | - | - |
ML:0.03887 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8215 | Li2 Ce2 Sn4 | mp-20754.cif | mp-Li | - | - | - |
ML:0.03344 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8214 | Li1 Si3 Pd1 | mp-20747.cif | mp-Li | - | - | - |
ML:3.313e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 8213 | Li2 Co2 As2 | mp-20698.cif | mp-Li | - | - | - |
ML:0.00759 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|