├── Atom_number2.py ├── EMC.sh ├── README.md ├── astom_constrian_readme.docx ├── atom_constrain.py ├── bonlen_angle_lat_d_layer.py ├── cp_file_to_bin.sh ├── defect.sh ├── defect_coord_center.py ├── dielect.py ├── heterojunction.py ├── m_n_supercell_new.py ├── multiplayer.py ├── multiplayer1.py ├── pband_plot_ljc_lxf_v4.py ├── supper_cell.sh ├── 关于用MS切面的经验.pdf └── 异质结构建教程.pdf /Atom_number2.py: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/lxf-gzu/vasp_small_script/HEAD/Atom_number2.py -------------------------------------------------------------------------------- /EMC.sh: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/lxf-gzu/vasp_small_script/HEAD/EMC.sh -------------------------------------------------------------------------------- /README.md: -------------------------------------------------------------------------------- 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