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选择 ID 化学式 原始文件名 数据集 标记摘要 AutoNEP NEP_300K SCREEN
21406 Li55 Ca3 La21 Zr14 W2 O96 Li6.9La2.6Ca0.4Zr1.75W0.25O12.cif test - 6.088e-04 S/cm 0.303 mS/cm
ML:0.3349 mS/cm AutoNEP:6.088e-04 S/cm NEP_300K:0.303 mS/cm GII:- 3D 阈值:- 状态:通过 半径:0.5445 Å 3D:1.754 Li 位点:2.378
21405 Li51 La24 Zr16 Ge1 O96 Li6.6Ge0.10La3Zr2O12.cif test - 0.003435 S/cm 0.8071 mS/cm
ML:0.3755 mS/cm AutoNEP:0.003435 S/cm NEP_300K:0.8071 mS/cm GII:- 3D 阈值:- 状态:通过 半径:0.5375 Å 3D:1.832 Li 位点:2.38
21404 Li51 La24 Zr12 Ta4 O96 Li6.5La3Zr1.5Ta0.5O12.cif test - - -
ML:0.364 mS/cm AutoNEP:- NEP_300K:- GII:- 3D 阈值:- 状态:- 半径:- 3D:- Li 位点:-
21403 Li51 La24 Ta4 Sn12 O96 Li6.5La3Sn1.5Ta0.5O12.cif test - 0.001667 S/cm 0.3441 mS/cm
ML:0.01594 mS/cm AutoNEP:0.001667 S/cm NEP_300K:0.3441 mS/cm GII:- 3D 阈值:- 状态:通过 半径:0.503 Å 3D:1.832 Li 位点:2.318
21402 Li51 La24 Zr16 Al1 Ga1 O96 Li6.4Al0.05Ga0.15La3Zr2O12.cif test - 0.001356 S/cm 0.1386 mS/cm
ML:0.5188 mS/cm AutoNEP:0.001356 S/cm NEP_300K:0.1386 mS/cm GII:- 3D 阈值:- 状态:通过 半径:0.5365 Å 3D:1.749 Li 位点:2.406
21401 Li50 La24 Zr16 Al2 O96 Li6.25Al0.25La3Zr2O12.cif test - 2.630e-04 S/cm 0.4661 mS/cm
ML:0.28 mS/cm AutoNEP:2.630e-04 S/cm NEP_300K:0.4661 mS/cm GII:- 3D 阈值:- 状态:通过 半径:0.538 Å 3D:1.72 Li 位点:2.371
21400 Li40 La24 Bi16 O96 Li5La3Bi2O12.cif test - - -
ML:0.01929 mS/cm AutoNEP:- NEP_300K:- GII:- 3D 阈值:- 状态:- 半径:- 3D:- Li 位点:-
21399 Li22 P4 S19 Cl5 Li5.5PS4.5Cl1.5.cif test - 0.01898 S/cm 6.159 mS/cm
ML:0.168 mS/cm AutoNEP:0.01898 S/cm NEP_300K:6.159 mS/cm GII:- 3D 阈值:- 状态:无法计算 半径:- 3D:- Li 位点:-
21398 Li18 Y6 Cl36 Li3YCl6.cif test - 0.1573 S/cm 20.68 mS/cm
ML:0.07134 mS/cm AutoNEP:0.1573 S/cm NEP_300K:20.68 mS/cm GII:- 3D 阈值:- 状态:未通过 半径:0.4795 Å 3D:2.222 Li 位点:2.083
21397 Li6 Y2 Br12 Li3YBr6.cif test - 0.1264 S/cm 50.16 mS/cm
ML:0.3616 mS/cm AutoNEP:0.1264 S/cm NEP_300K:50.16 mS/cm GII:- 3D 阈值:- 状态:通过 半径:0.5085 Å 3D:2.412 Li 位点:2.105
21396 Li4 In2 Cl11 Li3InCl6__2.cif test - 2.777 S/cm 28.67 mS/cm
ML:0.2126 mS/cm AutoNEP:2.777 S/cm NEP_300K:28.67 mS/cm GII:- 3D 阈值:- 状态:通过 半径:0.6065 Å 3D:2.095 Li 位点:2.376
21395 Li6 In2 Cl12 Li3InCl6.cif test - 0.01058 S/cm 78.53 mS/cm
ML:0.141 mS/cm AutoNEP:0.01058 S/cm NEP_300K:78.53 mS/cm GII:- 3D 阈值:- 状态:通过 半径:0.509 Å 3D:2.175 Li 位点:2.123
21394 Li3 La4 Ti6 O20 Li1.8La2Ti2.8Nb0.2O10.cif test - 7.752e-07 S/cm 9.390e-04 mS/cm
ML:1.086e-06 mS/cm AutoNEP:7.752e-07 S/cm NEP_300K:9.390e-04 mS/cm GII:- 3D 阈值:- 状态:通过 半径:0.702 Å 3D:1.202 Li 位点:5.473
21393 Li8 Ti10 Al2 P18 O72 Li1.3Al0.3Ti1.7(PO4)3.cif test - 1.197e-04 S/cm 3.448 mS/cm
ML:1.241 mS/cm AutoNEP:1.197e-04 S/cm NEP_300K:3.448 mS/cm GII:- 3D 阈值:- 状态:通过 半径:0.737 Å 3D:2.23 Li 位点:13.28
21392 Li7 Sc1 Ti11 P18 O72 Li1.2Ti1.8Sc0.2(PO4)3.cif test - 0.002982 S/cm 8.34 mS/cm
ML:0.8926 mS/cm AutoNEP:0.002982 S/cm NEP_300K:8.34 mS/cm GII:- 3D 阈值:- 状态:通过 半径:0.6745 Å 3D:2.27 Li 位点:4.789
21391 Li24 Gd4 B12 O36 ICSD-1_CollCode96123.cif default - - -
ML:- AutoNEP:- NEP_300K:- GII:- 3D 阈值:- 状态:通过 半径:0.777 Å 3D:1.614 Li 位点:6.311
21390 Li4 Er4 O8 ICSD-1_CollCode95381.cif default - - -
ML:- AutoNEP:- NEP_300K:- GII:- 3D 阈值:- 状态:未通过 半径:0.7555 Å 3D:1.425 Li 位点:-
21389 Ba6 Li6 B54 O90 ICSD-1_CollCode95115.cif default - 6.225e-05 S/cm 3.145e-04 mS/cm
ML:- AutoNEP:6.225e-05 S/cm NEP_300K:3.145e-04 mS/cm GII:- 3D 阈值:- 状态:通过 半径:1.075 Å 3D:1.652 Li 位点:2.549
21388 Li8 Zr4 O12 ICSD-1_CollCode94897.cif default - 3.970e-09 S/cm 2.869e-06 mS/cm
ML:- AutoNEP:3.970e-09 S/cm NEP_300K:2.869e-06 mS/cm GII:- 3D 阈值:- 状态:通过 半径:0.569 Å 3D:1.788 Li 位点:2.357
21387 Li8 Zr4 O12 ICSD-1_CollCode94896.cif default - - -
ML:- AutoNEP:- NEP_300K:- GII:- 3D 阈值:- 状态:通过 半径:0.565 Å 3D:1.787 Li 位点:2.325
21386 Li8 Zr4 O12 ICSD-1_CollCode94895.cif default - - -
ML:- AutoNEP:- NEP_300K:- GII:- 3D 阈值:- 状态:通过 半径:0.561 Å 3D:1.787 Li 位点:2.315
21385 Li8 Zr4 O12 ICSD-1_CollCode94894.cif default - 1.623e-06 S/cm 2.369e-05 mS/cm
ML:- AutoNEP:1.623e-06 S/cm NEP_300K:2.369e-05 mS/cm GII:- 3D 阈值:- 状态:通过 半径:0.5615 Å 3D:1.786 Li 位点:2.305
21384 Li8 Zr4 O12 ICSD-1_CollCode94893.cif default - 2.425e-10 S/cm 2.550e-05 mS/cm
ML:- AutoNEP:2.425e-10 S/cm NEP_300K:2.550e-05 mS/cm GII:- 3D 阈值:- 状态:通过 半径:0.533 Å 3D:1.821 Li 位点:2.252
21383 Li12 In4 B8 O24 ICSD-1_CollCode94355.cif default - 7.048e-05 S/cm 1.292e-05 mS/cm
ML:- AutoNEP:7.048e-05 S/cm NEP_300K:1.292e-05 mS/cm GII:- 3D 阈值:- 状态:通过 半径:0.589 Å 3D:1.682 Li 位点:2.81
21382 Ba6 Li6 B54 O90 ICSD-1_CollCode93013.cif default - 0.004127 S/cm 0.2029 mS/cm
ML:- AutoNEP:0.004127 S/cm NEP_300K:0.2029 mS/cm GII:- 3D 阈值:- 状态:通过 半径:1.085 Å 3D:1.671 Li 位点:2.517
21381 Li18 Al18 Si18 O72 ICSD-1_CollCode92708.cif default - - -
ML:- AutoNEP:- NEP_300K:- GII:- 3D 阈值:- 状态:通过 半径:1.127 Å 3D:1.714 Li 位点:6.098
21380 Li2 Sc2 P4 O14 ICSD-1_CollCode91496.cif default - 6.079e-08 S/cm 2.282e-07 mS/cm
ML:- AutoNEP:6.079e-08 S/cm NEP_300K:2.282e-07 mS/cm GII:- 3D 阈值:- 状态:通过 半径:0.8185 Å 3D:1.355 Li 位点:6.546
21379 Li4 Zr8 P12 O48 ICSD-1_CollCode91112.cif default - 1.354e-08 S/cm 4.066e-08 mS/cm
ML:- AutoNEP:1.354e-08 S/cm NEP_300K:4.066e-08 mS/cm GII:- 3D 阈值:- 状态:通过 半径:0.831 Å 3D:1.599 Li 位点:10.8
21378 Li8 Si16 B8 O48 ICSD-1_CollCode90849.cif default - - -
ML:- AutoNEP:- NEP_300K:- GII:- 3D 阈值:- 状态:通过 半径:0.75 Å 3D:1.308 Li 位点:11.28
21377 Li8 Zn4 Si4 O16 ICSD-1_CollCode8237.cif default - - -
ML:- AutoNEP:- NEP_300K:- GII:- 3D 阈值:- 状态:通过 半径:0.621 Å 3D:1.514 Li 位点:2.626
21376 Li8 Bi8 O24 ICSD-1_CollCode82277.cif default - 1.223 S/cm 0.05457 mS/cm
ML:- AutoNEP:1.223 S/cm NEP_300K:0.05457 mS/cm GII:- 3D 阈值:- 状态:通过 半径:0.508 Å 3D:1.61 Li 位点:5.162
21375 Li4 Zn4 P4 O16 ICSD-1_CollCode79352.cif default - 1.713e-18 S/cm 6.442e-07 mS/cm
ML:- AutoNEP:1.713e-18 S/cm NEP_300K:6.442e-07 mS/cm GII:- 3D 阈值:- 状态:通过 半径:0.686 Å 3D:2.143 Li 位点:2.823
21374 Cs2 Na6 Li24 Ge8 O32 ICSD-1_CollCode79098.cif default - 0.01112 S/cm 0.006152 mS/cm
ML:- AutoNEP:0.01112 S/cm NEP_300K:0.006152 mS/cm GII:- 3D 阈值:- 状态:通过 半径:0.65 Å 3D:1.477 Li 位点:3.182
21373 Li40 Si8 Pb4 O40 ICSD-1_CollCode78326.cif default - 3.638e-06 S/cm -
ML:- AutoNEP:3.638e-06 S/cm NEP_300K:- GII:- 3D 阈值:- 状态:通过 半径:0.631 Å 3D:1.691 Li 位点:4.334
21372 Li4 Al4 P16 O48 ICSD-1_CollCode74860.cif default - 0.0066 S/cm 0.01752 mS/cm
ML:- AutoNEP:0.0066 S/cm NEP_300K:0.01752 mS/cm GII:- 3D 阈值:- 状态:通过 半径:0.752 Å 3D:1.812 Li 位点:9.53
21371 K3 Li18 Ta3 O18 ICSD-1_CollCode73159.cif default - 3.133e-05 S/cm 0.2927 mS/cm
ML:- AutoNEP:3.133e-05 S/cm NEP_300K:0.2927 mS/cm GII:- 3D 阈值:- 状态:通过 半径:0.5925 Å 3D:1.668 Li 位点:2.337
21370 K2 Li8 Nb2 O10 ICSD-1_CollCode73124.cif default - 4.084e-04 S/cm 1.104e-04 mS/cm
ML:- AutoNEP:4.084e-04 S/cm NEP_300K:1.104e-04 mS/cm GII:- 3D 阈值:- 状态:通过 半径:0.642 Å 3D:1.936 Li 位点:4.205
21369 K1 Li6 Bi1 O6 ICSD-1_CollCode72840.cif default - 3.101e-13 S/cm 0.1158 mS/cm
ML:- AutoNEP:3.101e-13 S/cm NEP_300K:0.1158 mS/cm GII:- 3D 阈值:- 状态:通过 半径:0.6215 Å 3D:1.654 Li 位点:2.441
21368 Li12 Al4 Ge4 O20 ICSD-1_CollCode72099.cif default - 5.656e-08 S/cm 6.204e-05 mS/cm
ML:- AutoNEP:5.656e-08 S/cm NEP_300K:6.204e-05 mS/cm GII:- 3D 阈值:- 状态:通过 半径:0.6365 Å 3D:1.815 Li 位点:3.763
21367 Li12 Al4 Ge4 O20 ICSD-1_CollCode72098.cif default - 2.054e+04 S/cm 4.330e-05 mS/cm
ML:- AutoNEP:2.054e+04 S/cm NEP_300K:4.330e-05 mS/cm GII:- 3D 阈值:- 状态:通过 半径:0.6145 Å 3D:1.788 Li 位点:2.382
21366 K3 Li18 Bi3 O18 ICSD-1_CollCode71035.cif default - 0.003205 S/cm 0.5592 mS/cm
ML:- AutoNEP:0.003205 S/cm NEP_300K:0.5592 mS/cm GII:- 3D 阈值:- 状态:通过 半径:0.6145 Å 3D:1.689 Li 位点:2.382
21365 Li24 Y4 B12 O36 ICSD-1_CollCode68653.cif default - 0.002064 S/cm 4.928e-04 mS/cm
ML:- AutoNEP:0.002064 S/cm NEP_300K:4.928e-04 mS/cm GII:- 3D 阈值:- 状态:通过 半径:0.634 Å 3D:1.723 Li 位点:4.836
21364 Li2 Ge2 B2 O8 ICSD-1_CollCode67535.cif default - 2.458e-15 S/cm 5.958e-06 mS/cm
ML:- AutoNEP:2.458e-15 S/cm NEP_300K:5.958e-06 mS/cm GII:- 3D 阈值:- 状态:通过 半径:0.6315 Å 3D:1.122 Li 位点:3.606
21363 Li36 W18 O72 ICSD-1_CollCode67236.cif default - - -
ML:- AutoNEP:- NEP_300K:- GII:- 3D 阈值:- 状态:通过 半径:1.368 Å 3D:1.986 Li 位点:2.781
21362 Li4 Al4 Si4 O16 ICSD-1_CollCode66137.cif default - 8.494e-05 S/cm 0.001688 mS/cm
ML:- AutoNEP:8.494e-05 S/cm NEP_300K:0.001688 mS/cm GII:- 3D 阈值:- 状态:通过 半径:0.6855 Å 3D:1.561 Li 位点:4.991
21361 Li32 Zn32 P32 O128 ICSD-1_CollCode65764.cif default - 1.342e-12 S/cm 3.113e-06 mS/cm
ML:- AutoNEP:1.342e-12 S/cm NEP_300K:3.113e-06 mS/cm GII:- 3D 阈值:- 状态:通过 半径:0.628 Å 3D:1.444 Li 位点:6.233
21360 K4 Li28 Zr6 O28 ICSD-1_CollCode65445.cif default - 1.939e-12 S/cm 0.07705 mS/cm
ML:- AutoNEP:1.939e-12 S/cm NEP_300K:0.07705 mS/cm GII:- 3D 阈值:- 状态:通过 半径:0.5975 Å 3D:1.667 Li 位点:4.853
21359 Cs4 Li28 Tb6 O28 ICSD-1_CollCode65444.cif default - - -
ML:- AutoNEP:- NEP_300K:- GII:- 3D 阈值:- 状态:通过 半径:0.6085 Å 3D:2.037 Li 位点:5.745
21358 K8 Li32 Al8 O32 ICSD-1_CollCode65260.cif default - 9.883e-05 S/cm 0.03929 mS/cm
ML:- AutoNEP:9.883e-05 S/cm NEP_300K:0.03929 mS/cm GII:- 3D 阈值:- 状态:通过 半径:0.5995 Å 3D:1.92 Li 位点:3.112
21357 Li2 Al2 Si8 O20 ICSD-1_CollCode64962.cif default - 2.341e-05 S/cm 0.007755 mS/cm
ML:- AutoNEP:2.341e-05 S/cm NEP_300K:0.007755 mS/cm GII:- 3D 阈值:- 状态:通过 半径:0.9585 Å 3D:1.437 Li 位点:8.51