| 选择 | ID | 化学式 | 原始文件名 | 数据集 | 标记摘要 | AutoNEP | NEP_300K | SCREEN |
|---|---|---|---|---|---|---|---|---|
| 9244 | Li4 Ca8 Ge12 | mp-504670.cif | mp-Li | - | - | - |
ML:0.01073 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 9243 | Li14 I2 N4 | mp-504574.cif | mp-Li | - | - | - |
ML:0.02089 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 9242 | Li3 Mn3 Ga3 F18 | mp-504460.cif | mp-Li | - | - | - |
ML:8.235e-05 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 9241 | Li4 H20 S4 N8 O16 | mp-504426.cif | mp-Li | - | - | - |
ML:5.980e-06 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 9240 | Li12 Mn10 P16 O56 | mp-504387.cif | mp-Li | - | - | - |
ML:0.001767 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.7675 Å
3D:1.993
Li 位点:9.647
|
|
| 9239 | Li12 Fe8 P12 O48 | mp-504385.cif | mp-Li | - | - | - |
ML:0.02331 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.694 Å
3D:1.8
Li 位点:9.742
|
|
| 9238 | Li12 Co10 P16 O56 | mp-504376.cif | mp-Li | - | - | - |
ML:0.001553 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.744 Å
3D:1.718
Li 位点:9.375
|
|
| 9237 | Li2 Ni12 P14 O48 | mp-504371.cif | mp-Li | - | - | - |
ML:0.006115 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.5985 Å
3D:2.804
Li 位点:4.734
|
|
| 9236 | Li12 V6 P16 O58 | mp-504367.cif | mp-Li | - | - | - |
ML:3.442e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.864 Å
3D:1.728
Li 位点:8.533
|
|
| 9235 | Li2 Cr12 P14 O48 | mp-504358.cif | mp-Li | - | - | - |
ML:2.036e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.66 Å
3D:1.338
Li 位点:2.279
|
|
| 9234 | Li2 Bi2 P8 O24 | mp-504354.cif | mp-Li | - | - | - |
ML:1.019e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.6665 Å
3D:1.779
Li 位点:2.779
|
|
| 9233 | Li2 Sb2 P8 O24 | mp-504353.cif | mp-Li | - | - | - |
ML:3.290e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.7675 Å
3D:1.788
Li 位点:5.92
|
|
| 9232 | Li6 Cu2 P4 O16 | mp-504348.cif | mp-Li | - | - | - |
ML:2.245e-06 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.648 Å
3D:1.481
Li 位点:6.562
|
|
| 9231 | Li6 Cr2 P4 O18 | mp-504343.cif | mp-Li | - | - | - |
ML:9.463e-05 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.6915 Å
3D:1.935
Li 位点:7.078
|
|
| 9230 | Li2 Sb2 P8 O24 | mp-504340.cif | mp-Li | - | - | - |
ML:0.005967 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:1.083 Å
3D:1.702
Li 位点:4.286
|
|
| 9229 | Li4 Cr4 P4 O16 | mp-504313.cif | mp-Li | - | - | - |
ML:1.104e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.732 Å
3D:1.481
Li 位点:5.474
|
|
| 9228 | Li4 Cr4 P4 O16 | mp-504307.cif | mp-Li | - | - | - |
ML:7.326e-05 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:1.326 Å
3D:1.566
Li 位点:-
|
|
| 9227 | Li4 Cu4 P4 O16 | mp-504304.cif | mp-Li | - | - | - |
ML:6.636e-07 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.751 Å
3D:1.695
Li 位点:2.952
|
|
| 9226 | Li12 Ni8 P12 O48 | mp-504271.cif | mp-Li | - | - | - |
ML:1.877e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.652 Å
3D:1.727
Li 位点:10.8
|
|
| 9225 | Li4 Cu4 P4 O16 | mp-504264.cif | mp-Li | - | - | - |
ML:2.954e-07 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.552 Å
3D:1.501
Li 位点:1.985
|
|
| 9224 | Li14 Co9 P16 O56 | mp-504263.cif | mp-Li | - | - | - |
ML:1.898e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.696 Å
3D:1.789
Li 位点:8.345
|
|
| 9223 | Li2 Co2 P6 O18 | mp-504262.cif | mp-Li | - | - | - |
ML:7.387e-07 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.5815 Å
3D:1.547
Li 位点:5.548
|
|
| 9222 | Li4 Cu16 P12 O48 | mp-504260.cif | mp-Li | - | - | - |
ML:2.534e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.579 Å
3D:3.044
Li 位点:4.049
|
|
| 9221 | Li16 Ni16 P16 O64 | mp-504246.cif | mp-Li | - | - | - |
ML:6.681e-05 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.6685 Å
3D:1.704
Li 位点:6.298
|
|
| 9220 | Li9 Ni9 P12 O48 | mp-504236.cif | mp-Li | - | - | - |
ML:1.836e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.5925 Å
3D:2.221
Li 位点:8.225
|
|
| 9219 | Li2 Co4 P6 O20 | mp-504230.cif | mp-Li | - | - | - |
ML:1.193e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.921 Å
3D:1.871
Li 位点:5.5
|
|
| 9218 | Li2 Sn2 P6 O18 | mp-504211.cif | mp-Li | - | - | - |
ML:0.007794 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.7595 Å
3D:1.566
Li 位点:6.459
|
|
| 9217 | Li2 Sb2 P8 O24 | mp-504207.cif | mp-Li | - | - | - |
ML:0.005169 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.718 Å
3D:1.824
Li 位点:4.72
|
|
| 9216 | Li4 V4 P20 O60 | mp-504206.cif | mp-Li | - | - | - |
ML:0.001884 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.9465 Å
3D:1.562
Li 位点:9.767
|
|
| 9215 | Li4 Mo4 P4 O20 | mp-504194.cif | mp-Li | - | 0.073 S/cm | 0.09703 mS/cm |
ML:0.001091 mS/cm
AutoNEP:0.073 S/cm
NEP_300K:0.09703 mS/cm
GII:-
3D 阈值:-
状态:通过
半径:0.6515 Å
3D:2.033
Li 位点:5.788
|
|
| 9214 | Li4 Fe4 P4 O16 | mp-504184.cif | mp-Li | - | - | - |
ML:7.050e-08 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.757 Å
3D:1.388
Li 位点:4.188
|
|
| 9213 | Li4 Fe4 P12 O36 | mp-504179.cif | mp-Li | - | - | - |
ML:0.001027 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.6275 Å
3D:1.457
Li 位点:2.972
|
|
| 9212 | Li16 Mn16 P16 O64 | mp-504178.cif | mp-Li | - | - | - |
ML:4.612e-05 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.711 Å
3D:1.616
Li 位点:4.322
|
|
| 9211 | Li8 Mo2 P4 O18 | mp-504158.cif | mp-Li | - | - | - |
ML:6.368e-05 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.6835 Å
3D:1.899
Li 位点:6.729
|
|
| 9210 | Li2 Bi4 P6 O24 | mp-504151.cif | mp-Li | - | - | - |
ML:0.003766 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.808 Å
3D:2.252
Li 位点:3.763
|
|
| 9209 | Li12 Ni8 P12 O48 | mp-504139.cif | mp-Li | - | - | - |
ML:7.636e-05 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.603 Å
3D:2.063
Li 位点:3.285
|
|
| 9208 | Li8 Fe4 P8 O28 | mp-504122.cif | mp-Li | - | - | - |
ML:1.114e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.786 Å
3D:1.85
Li 位点:6.93
|
|
| 9207 | Li4 Ti4 P4 O16 | mp-504106.cif | mp-Li | beta-D、势函数可信 | 1.448e-05 S/cm | 2.290e-04 mS/cm |
ML:3.516e-05 mS/cm
AutoNEP:1.448e-05 S/cm
NEP_300K:2.290e-04 mS/cm
GII:-
3D 阈值:-
状态:未通过
半径:0.654 Å
3D:1.78
Li 位点:2.043
|
|
| 9206 | Li4 P4 W4 O16 | mp-504105.cif | mp-Li | - | - | - |
ML:4.125e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.6075 Å
3D:1.977
Li 位点:1.802
|
|
| 9205 | Li2 W4 O8 | mp-504103.cif | mp-Li | beta-A | 2.021e-09 S/cm | 0.005185 mS/cm |
ML:3.078e-07 mS/cm
AutoNEP:2.021e-09 S/cm
NEP_300K:0.005185 mS/cm
GII:-
3D 阈值:-
状态:未通过
半径:0.755 Å
3D:3.399
Li 位点:1.755
|
|
| 9204 | Li2 Ni4 O8 | mp-504102.cif | mp-Li | - | - | - |
ML:2.378e-08 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.5515 Å
3D:3.458
Li 位点:1.883
|
|
| 9203 | Li4 Si2 O6 | mp-5012.cif | mp-Li | - | - | - |
ML:5.779e-12 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.5805 Å
3D:1.776
Li 位点:1.44
|
|
| 9202 | Li12 B4 N8 | mp-5001.cif | mp-Li | - | - | - |
ML:2.385e-04 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 9201 | Li4 Sb4 O12 | mp-4995.cif | mp-Li | - | - | - |
ML:2.542e-12 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.5235 Å
3D:2.398
Li 位点:-
|
|
| 9200 | Li1 Pr2 Ge6 | mp-4960.cif | mp-Li | - | - | - |
ML:0.001648 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 9199 | Li1 Ga2 Rh1 | mp-4913.cif | mp-Li | - | - | - |
ML:8.423e-05 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 9198 | Li12 Se6 O24 | mp-4855.cif | mp-Li | - | - | - |
ML:2.527e-06 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:1.026 Å
3D:1.782
Li 位点:4.539
|
|
| 9197 | Li56 V8 N32 | mp-4825.cif | mp-Li | - | - | - |
ML:3.086e-05 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:无法计算
半径:-
3D:-
Li 位点:-
|
|
| 9196 | Li8 Te2 O10 | mp-4804.cif | mp-Li | - | - | - |
ML:4.902e-05 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:未通过
半径:0.5285 Å
3D:1.759
Li 位点:2.133
|
|
| 9195 | Li8 B16 O28 | mp-4779.cif | mp-Li | - | - | - |
ML:3.053e-10 mS/cm
AutoNEP:-
NEP_300K:-
GII:-
3D 阈值:-
状态:通过
半径:0.6175 Å
3D:1.531
Li 位点:2.875
|