pymatgen_graphene
资源文件列表
graphene/opt/OSZICAR , 1855
graphene/opt/OUTCAR , 70925
graphene/opt/POSCAR , 245
graphene/opt/EIGENVAL , 5962
graphene/opt/INCAR , 222
graphene/opt/XDATCAR , 257
graphene/opt/IBZKPT , 1932
graphene/opt/CONTCAR , 555
graphene/opt/vasprun.xml , 48825
graphene/opt/POTCAR , 140610
graphene/opt/PCDAT , 234
graphene/opt/CHGCAR , 8947014
graphene/opt/KPOINTS , 31
graphene/opt/DOSCAR , 11073
graphene/bands/INCAR , 207
graphene/bands/POTCAR , 140610
graphene/bands/POSCAR , 555
graphene/bands/vasprun.xml , 345553
graphene/bands/OUTCAR , 80485
graphene/bands/EIGENVAL , 20977
graphene/bands/CONTCAR , 555
graphene/bands/DOSCAR , 83453
graphene/bands/OSZICAR , 713
graphene/bands/PCDAT , 234
graphene/bands/XDATCAR , 283
graphene/bands/CHG , 5947672
graphene/bands/PROCAR , 259828
graphene/bands/KPOINTS , 204
graphene/dos/OSZICAR , 1855
graphene/dos/OUTCAR , 6066712
graphene/dos/POSCAR , 555
graphene/dos/EIGENVAL , 194458
graphene/dos/INCAR , 195
graphene/dos/XDATCAR , 283
graphene/dos/IBZKPT , 320214
graphene/dos/CONTCAR , 555
graphene/dos/vasprun.xml , 3157782
graphene/dos/POTCAR , 140610
graphene/dos/PCDAT , 234
graphene/dos/KPOINTS , 31
graphene/dos/DOSCAR , 552377
graphene/graphene.png , 84586
graphene/graphene.pdf , 79989
graphene/graphene.py , 5691