OverviewΒΆ
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
------------>>
0
o---------------------------------------------------------------o
| * 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 |
o---------------------------------------------------------------o