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An interactive Python script that computes the minimum atomic bonding distances from sites, generating histograms and pair counts.
Microstructure Intelligent Design Core (Ver. beta)
Resources about Phase Field Tutorial
Book_7_《机器学习》 | 鸢尾花书:从加减乘除到机器学习;欢迎批评指正
Book_6_《数据有道》 | 鸢尾花书:从加减乘除到机器学习;欢迎大家批评指正!纠错多的同学会得到赠书感谢!
Book_5_《统计至简》 | 鸢尾花书:从加减乘除到机器学习;上架!
A cheatsheet for those who plot with MATLAB
《Hello 算法》:动画图解、一键运行的数据结构与算法教程。支持 Python, Java, C++, C, C#, JS, Go, Swift, Rust, Ruby, Kotlin, TS, Dart 代码。简体版和繁体版同步更新,English version ongoing
Book_4_《矩阵力量》 | 鸢尾花书:从加减乘除到机器学习;上架!
Book_3_《数学要素》 | 鸢尾花书:从加减乘除到机器学习;上架;欢迎继续纠错,纠错多的同学还会有赠书!
Book_2_《可视之美》 | 鸢尾花书:从加减乘除到机器学习,欢迎批评指正
Book_1_《编程不难》 | 鸢尾花书:从加减乘除到机器学习;请多多批评指正!
Dealing with slabs for first principles calculations of surfaces
A suite of scripts and modules that perform menial, tedious and repetitive tasks and operations on VASP files that were hurriedly and haphazardly put together by some intern.
A wrapper for many computational codes of thermal conductivity
This WaNo performs the DFT calculation using Vasp code. In this WaNo, the POTCAR might be automatically generated after reading the POSCAR file.
Python Processing Tool for Vasp Ipnut/Output
A collection of tools for pre-processing, simulating, and post-processing vascular fluid-structure-interaction problems
Plot band structures from VASP band calculation with matplotlib
High-throughput DFT of MOFs using ASE/VASP
VASP subtool to draw Fermi-Surface; creates input file for Xcrysden
Code to convert DFPT modes in OUTCAR files to VESTA images