Overview¶

VASPKIT aims at providing a powerful and user-friendly interface to perform high throughput analysis of various material properties from the raw calculated data using the widely-used VASP code. The program can be conveniently run under either the interactive user interface or command line mode.

 > vaspkit

            \\\///
           / _  _ \         Hey, you must know what you are doing.
         (| (o)(o) |)       Otherwise you might get wrong results.
 o-----.OOOo--()--oOOO.------------------------------------------o
 |         VASPKIT Standard Edition 1.4.0 (02 Nov. 2022)         |
 |         Core Developer: Vei WANG (wangvei@icloud.com)         |
 |      Main Contributors: Gang TANG, Nan XU & Jin-Cheng LIU     |
 |  Online Tutorials Available on Website: https://vaspkit.com   |
 o-----.oooO-----------------------------------------------------o
        (   )   Oooo.                          VASPKIT Made Simple
         \ (    (   )
          \_)    ) /
                (_/
 ===================== Structural Utilities ======================
 1)  VASP Input-Files Generator    2)  Mechanical Properties
 3)  K-Path for Band-Structure     4)  Structure Editor
 5)  Catalysis-ElectroChem Kit     6)  Symmetry Analysis
 7)  Materials Databases           8)  Advanced Structure Models
 ===================== Electronic Utilities ======================
 11) Density-of-States             21) Band-Structure
 23) 3D Band-Structure             25) Hybrid-DFT Band-Structure
 26) Fermi-Surface                 28) Band-Structure Unfolding
 31) Charge-Density Analysis       42) Potential Analysis
 51) Wave-Function Analysis        62) Magnetic Properties
 65) Spin-Texture                  68) Transport Properties
 ======================== Misc Utilities =========================
 71) Optical Properties            72) Molecular-Dynamics Kit
 74) User Interface                78) VASP2other Interface
 91) Semiconductor Kit             92) 2D-Material Kit
 0)  Quit
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0
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 |                       * ACKNOWLEDGMENTS *                     |
 | Other Contributors (in no particular order): Peng-Fei LIU,    |
 | Xue-Fei LIU, Dao-Xiong WU, Zhao-Fu ZHANG, Tian WANG, Qiang LI,|
 | Ya-Chao LIU, Jiang-Shan ZHAO, Qi-Jing ZHENG, Yue QIU and You! |
 | Advisors: Wen-Tong GENG, Yoshiyuki KAWAZOE                    |
 :) Any Suggestions for Improvement are Welcome and Appreciated (:
 |---------------------------------------------------------------|
 |                          * CITATIONS *                        |
 | When using VASPKIT in your research PLEASE cite the paper:    |
 | [1] V. WANG, N. XU, J.-C. LIU, G. TANG, W.-T. GENG, VASPKIT: A|
 | User-Friendly Interface Facilitating High-Throughput Computing|
 | and Analysis Using VASP Code, Computer Physics Communications |
 | 267, 108033, (2021), DOI: 10.1016/j.cpc.2021.108033           |
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