vasp电池小班课件
资源文件列表
Package/1.VASP计算基础.pdf , 916844
Package/2.电池材料的热力学分析（一）.pdf , 1966505
Package/3.电池材料的热力学分析（二）.pdf , 849819
Package/4.电池材料的动力学分析.pdf , 1310939
Package/5.电池材料的电子结构分析.pdf , 1095308
Package/References/1.1323224.pdf , 512255
Package/References/1.1329672.pdf , 172894
Package/References/nl4007479.pdf , 639401
Package/References/nn102598m.pdf , 912021
Package/Scripts/bader , 2223173
Package/Scripts/chgdiff , 1806
Package/Scripts/chgsum.pl , 1905
Package/Scripts/CuInSe2_Stability_Diagram.m , 3351
Package/Scripts/Diffusion_Ionic_Conductivity.asv , 927
Package/Scripts/Diffusion_Ionic_Conductivity.m , 1460
Package/Scripts/DOSProcess.m , 3272
Package/Scripts/gk.f , 2887
Package/Scripts/gk.x , 690284
Package/Scripts/MoS2_Form_Energy.m , 1775
Package/Scripts/nebbarrier.pl , 3650
Package/Scripts/nebconverge.pl , 1683
Package/Scripts/nebmake.pl , 5324
Package/Scripts/nebresults.pl , 1780
Package/Scripts/nebspline.pl , 3003
Package/Scripts/vfin.pl , 1527
Package/VASP_Files/Examples_1/Graphene_Defect/Armchair_Edge/CONTCAR , 12172
Package/VASP_Files/Examples_1/Graphene_Defect/Armchair_Edge/INCAR , 421
Package/VASP_Files/Examples_1/Graphene_Defect/Armchair_Edge/KPOINTS , 46
Package/VASP_Files/Examples_1/Graphene_Defect/Armchair_Edge/OSZICAR , 42326
Package/VASP_Files/Examples_1/Graphene_Defect/Armchair_Edge/POSCAR , 3051
Package/VASP_Files/Examples_1/Graphene_Defect/Armchair_Edge/POTCAR , 207211
Package/VASP_Files/Examples_1/Graphene_Defect/Divacancy/CONTCAR , 7992
Package/VASP_Files/Examples_1/Graphene_Defect/Divacancy/INCAR , 421
Package/VASP_Files/Examples_1/Graphene_Defect/Divacancy/KPOINTS , 46
Package/VASP_Files/Examples_1/Graphene_Defect/Divacancy/OSZICAR , 35859
Package/VASP_Files/Examples_1/Graphene_Defect/Divacancy/POSCAR , 2115
Package/VASP_Files/Examples_1/Graphene_Defect/Divacancy/POTCAR , 207211
Package/VASP_Files/Examples_1/Graphene_Defect/Mixed_Edge/CONTCAR , 12612
Package/VASP_Files/Examples_1/Graphene_Defect/Mixed_Edge/INCAR , 421
Package/VASP_Files/Examples_1/Graphene_Defect/Mixed_Edge/KPOINTS , 46
Package/VASP_Files/Examples_1/Graphene_Defect/Mixed_Edge/OSZICAR , 83494
Package/VASP_Files/Examples_1/Graphene_Defect/Mixed_Edge/POSCAR , 3159
Package/VASP_Files/Examples_1/Graphene_Defect/Mixed_Edge/POTCAR , 207211
Package/VASP_Files/Examples_1/Graphene_Defect/Perfect/CONTCAR , 8212
Package/VASP_Files/Examples_1/Graphene_Defect/Perfect/INCAR , 421
Package/VASP_Files/Examples_1/Graphene_Defect/Perfect/KPOINTS , 46
Package/VASP_Files/Examples_1/Graphene_Defect/Perfect/OSZICAR , 1803
Package/VASP_Files/Examples_1/Graphene_Defect/Perfect/POSCAR , 2174
Package/VASP_Files/Examples_1/Graphene_Defect/Perfect/POTCAR , 207211
Package/VASP_Files/Examples_1/Graphene_Defect/Single_Vacancy/CONTCAR , 8102
Package/VASP_Files/Examples_1/Graphene_Defect/Single_Vacancy/INCAR , 421
Package/VASP_Files/Examples_1/Graphene_Defect/Single_Vacancy/KPOINTS , 46
Package/VASP_Files/Examples_1/Graphene_Defect/Single_Vacancy/OSZICAR , 67596
Package/VASP_Files/Examples_1/Graphene_Defect/Single_Vacancy/POSCAR , 2145
Package/VASP_Files/Examples_1/Graphene_Defect/Single_Vacancy/POTCAR , 207211
Package/VASP_Files/Examples_1/Graphene_Defect/Stone_Wales/CONTCAR , 8212
Package/VASP_Files/Examples_1/Graphene_Defect/Stone_Wales/INCAR , 421
Package/VASP_Files/Examples_1/Graphene_Defect/Stone_Wales/KPOINTS , 46
Package/VASP_Files/Examples_1/Graphene_Defect/Stone_Wales/OSZICAR , 30322
Package/VASP_Files/Examples_1/Graphene_Defect/Stone_Wales/POSCAR , 2172
Package/VASP_Files/Examples_1/Graphene_Defect/Stone_Wales/POTCAR , 207211
Package/VASP_Files/Examples_1/Graphene_Defect/Zigzag_Edge/CONTCAR , 10852
Package/VASP_Files/Examples_1/Graphene_Defect/Zigzag_Edge/INCAR , 421
Package/VASP_Files/Examples_1/Graphene_Defect/Zigzag_Edge/KPOINTS , 46
Package/VASP_Files/Examples_1/Graphene_Defect/Zigzag_Edge/OSZICAR , 24786
Package/VASP_Files/Examples_1/Graphene_Defect/Zigzag_Edge/POSCAR , 2725
Package/VASP_Files/Examples_1/Graphene_Defect/Zigzag_Edge/POTCAR , 207211
Package/VASP_Files/Examples_1/Graphene_Na/Bulk_Na/CONTCAR , 512
Package/VASP_Files/Examples_1/Graphene_Na/Bulk_Na/INCAR , 383
Package/VASP_Files/Examples_1/Graphene_Na/Bulk_Na/KPOINTS , 46
Package/VASP_Files/Examples_1/Graphene_Na/Bulk_Na/OSZICAR , 4802
Package/VASP_Files/Examples_1/Graphene_Na/Bulk_Na/POSCAR , 512
Package/VASP_Files/Examples_1/Graphene_Na/Bulk_Na/POTCAR , 183444
Package/VASP_Files/Examples_1/Graphene_Na/Na_001_Graphene/CONTCAR , 13723
Package/VASP_Files/Examples_1/Graphene_Na/Na_001_Graphene/INCAR , 430
Package/VASP_Files/Examples_1/Graphene_Na/Na_001_Graphene/KPOINTS , 46
Package/VASP_Files/Examples_1/Graphene_Na/Na_001_Graphene/OSZICAR , 86930
Package/VASP_Files/Examples_1/Graphene_Na/Na_001_Graphene/POSCAR , 3434
Package/VASP_Files/Examples_1/Graphene_Na/Na_001_Graphene/POTCAR , 390655
Package/VASP_Files/Examples_1/Graphene_Na/Na_001_Surface/CONTCAR , 8212
Package/VASP_Files/Examples_1/Graphene_Na/Na_001_Surface/INCAR , 431
Package/VASP_Files/Examples_1/Graphene_Na/Na_001_Surface/KPOINTS , 46
Package/VASP_Files/Examples_1/Graphene_Na/Na_001_Surface/OSZICAR , 18042
Package/VASP_Files/Examples_1/Graphene_Na/Na_001_Surface/POSCAR , 9077
Package/VASP_Files/Examples_1/Graphene_Na/Na_001_Surface/POTCAR , 183444
Package/VASP_Files/Examples_1/InCuSe2/Cu3Se2/CONTCAR , 1403
Package/VASP_Files/Examples_1/InCuSe2/Cu3Se2/INCAR , 349
Package/VASP_Files/Examples_1/InCuSe2/Cu3Se2/KPOINTS , 46
Package/VASP_Files/Examples_1/InCuSe2/Cu3Se2/OSZICAR , 9894
Package/VASP_Files/Examples_1/InCuSe2/Cu3Se2/POSCAR , 1403
Package/VASP_Files/Examples_1/InCuSe2/Cu3Se2/POTCAR , 449841
Package/VASP_Files/Examples_1/InCuSe2/CuSe2/CONTCAR , 963
Package/VASP_Files/Examples_1/InCuSe2/CuSe2/INCAR , 349
Package/VASP_Files/Examples_1/InCuSe2/CuSe2/KPOINTS , 46
Package/VASP_Files/Examples_1/InCuSe2/CuSe2/OSZICAR , 4610
Package/VASP_Files/Examples_1/InCuSe2/CuSe2/POSCAR , 290
Package/VASP_Files/Examples_1/InCuSe2/CuSe2/POTCAR , 449841
Package/VASP_Files/Examples_1/InCuSe2/CuSe/CONTCAR , 2943
Package/VASP_Files/Examples_1/InCuSe2/CuSe/INCAR , 349
Package/VASP_Files/Examples_1/InCuSe2/CuSe/KPOINTS , 46
Package/VASP_Files/Examples_1/InCuSe2/CuSe/OSZICAR , 54346
Package/VASP_Files/Examples_1/InCuSe2/CuSe/POSCAR , 835
Package/VASP_Files/Examples_1/InCuSe2/CuSe/POTCAR , 449841
Package/VASP_Files/Examples_1/InCuSe2/Cu/CONTCAR , 732
Package/VASP_Files/Examples_1/InCuSe2/Cu/INCAR , 349
Package/VASP_Files/Examples_1/InCuSe2/Cu/KPOINTS , 49
Package/VASP_Files/Examples_1/InCuSe2/Cu/OSZICAR , 3459
Package/VASP_Files/Examples_1/InCuSe2/Cu/POSCAR , 221
Package/VASP_Files/Examples_1/InCuSe2/Cu/POTCAR , 230210
Package/VASP_Files/Examples_1/InCuSe2/In2Se3/CONTCAR , 3603
Package/VASP_Files/Examples_1/InCuSe2/In2Se3/INCAR , 349
Package/VASP_Files/Examples_1/InCuSe2/In2Se3/KPOINTS , 46
Package/VASP_Files/Examples_1/InCuSe2/In2Se3/OSZICAR , 23392
Package/VASP_Files/Examples_1/InCuSe2/In2Se3/POSCAR , 1016
Package/VASP_Files/Examples_1/InCuSe2/In2Se3/POTCAR , 437216
Package/VASP_Files/Examples_1/InCuSe2/In3Cu7/CONTCAR , 4703
Package/VASP_Files/Examples_1/InCuSe2/In3Cu7/INCAR , 358
Package/VASP_Files/Examples_1/InCuSe2/In3Cu7/KPOINTS , 46
Package/VASP_Files/Examples_1/InCuSe2/In3Cu7/OSZICAR , 23177
Package/VASP_Files/Examples_1/InCuSe2/In3Cu7/POSCAR , 1318
Package/VASP_Files/Examples_1/InCuSe2/In3Cu7/POTCAR , 447795
Package/VASP_Files/Examples_1/InCuSe2/In7Cu10/CONTCAR , 7783
Package/VASP_Files/Examples_1/InCuSe2/In7Cu10/INCAR , 358
Package/VASP_Files/Examples_1/InCuSe2/In7Cu10/KPOINTS , 46
Package/VASP_Files/Examples_1/InCuSe2/In7Cu10/OSZICAR , 15643
Package/VASP_Files/Examples_1/InCuSe2/In7Cu10/POSCAR , 2157
Package/VASP_Files/Examples_1/InCuSe2/In7Cu10/POTCAR , 447795
Package/VASP_Files/Examples_1/InCuSe2/InCuSe2/CONTCAR , 2074
Package/VASP_Files/Examples_1/InCuSe2/InCuSe2/INCAR , 349
Package/VASP_Files/Examples_1/InCuSe2/InCuSe2/KPOINTS , 46
Package/VASP_Files/Examples_1/InCuSe2/InCuSe2/OSZICAR , 5168
Package/VASP_Files/Examples_1/InCuSe2/InCuSe2/POSCAR , 600
Package/VASP_Files/Examples_1/InCuSe2/InCuSe2/POTCAR , 667426
Package/VASP_Files/Examples_1/InCuSe2/InSe/CONTCAR , 1623
Package/VASP_Files/Examples_1/InCuSe2/InSe/INCAR , 349
Package/VASP_Files/Examples_1/InCuSe2/InSe/KPOINTS , 47
Package/VASP_Files/Examples_1/InCuSe2/InSe/OSZICAR , 30961
Package/VASP_Files/Examples_1/InCuSe2/InSe/POSCAR , 472
Package/VASP_Files/Examples_1/InCuSe2/InSe/POTCAR , 437216
Package/VASP_Files/Examples_1/InCuSe2/In/CONTCAR , 732
Package/VASP_Files/Examples_1/InCuSe2/In/INCAR , 349
Package/VASP_Files/Examples_1/InCuSe2/In/KPOINTS , 46
Package/VASP_Files/Examples_1/InCuSe2/In/OSZICAR , 2186
Package/VASP_Files/Examples_1/InCuSe2/In/POSCAR , 221
Package/VASP_Files/Examples_1/InCuSe2/In/POTCAR , 217585
Package/VASP_Files/Examples_1/InCuSe2/PD.tif , 35443
Package/VASP_Files/Examples_1/InCuSe2/Se/CONTCAR , 7332
Package/VASP_Files/Examples_1/InCuSe2/Se/INCAR , 349
Package/VASP_Files/Examples_1/InCuSe2/Se/KPOINTS , 46
Package/VASP_Files/Examples_1/InCuSe2/Se/OSZICAR , 23327
Package/VASP_Files/Examples_1/InCuSe2/Se/POSCAR , 7332
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