Popular repositories Loading

1. REANN REANN Public

   Forked from zhangylch/REANN

   Yaolong Zhang's great work

   Python 2

2. USTC-CS-Courses-Resource USTC-CS-Courses-Resource Public

   Forked from ustcwpz/USTC-CS-Courses-Resource

   ❤️中国科学技术大学计算机学院课程资源(https://mbinary.xyz/ustc-cs/)

   C++ 1

3. RPMD_428 RPMD_428 Public

   the program is applied for molecular dynamics on the surface due to the difference between QCT and QD results

   Fortran 1

4. Equivariant-MPNN Equivariant-MPNN Public

   mpnn

   Python 1

5. RPMDrate RPMDrate Public

   Forked from GreenGroup/RPMDrate

   Compute dynamic properties of chemical systems using ring polymer molecular dynamics simulations

   Python

6. JADE JADE Public

   Forked from jade-package/JADE

   JADE: an on-the-fly surface hopping package for poly-atomic systems developed by Prof. Z. Lan and co-workers (http://jade-package.github.io/JADE)

   Python