zjwang11/UnconvMat zjwang11/UnconvMat

  • Stars
    star
    11
  • Rank 1,694,829 (Top 34 %)
  • Language
  • Created over 3 years ago
  • Updated over 2 years ago
Twitter logo Share LinkedIn logo Share Facebook logo Share
zjwang11/UnconvMat
github

zjwang11

Reviews

There are no reviews yet. Be the first to send feedback to the community and the maintainers!

Repository Details

to solve the aBR decomposition online for an unconventional material or obstructed atomic insulator (OAI). "Unconventional materials", Sci. Bul. 67(6), 598-608 (2022).

More Repositories

1

IRVSP

IRVSP: to obtain irreducible representations of electronic states in the VASP, Comput. Phys. Comm. 261, 107760 (2021). https://doi.org/10.1016/j.cpc.2020.107760.
Makefile
103
star
2

VASP2KP

to compute kp parameters and Lande g-factors directly from the VASP wavefunctions. Ref: Zhang et al., Chin. Phys. Lett. 40, 127101 (2023) https://doi.org/10.1088/0256-307X/40/12/127101
MATLAB
19
star
3

TopMat

An automatic workflow to search for topological materials in 1651 magnetic space groups. Ref: J. Gao, et al. "Magnetic band representations, Fu-Kane-like symmetry indicators, and magnetic topological materials", Phys. Rev. B 106, 035150 (2022). https://doi.org/10.1103/PhysRevB.106.035150
10
star
4

IR2PW

to compute Irreducible Representations by linking the libIRVSP.a to PWscf/QE code and phonon modes. R. Ref: Zhang, et al. Phys. Rev. Research 5, 023142 (2023). https://doi.org/10.1103/PhysRevResearch.5.023142.
Python
8
star
5

ebooks

3
star
6

soccerAir

macbookAir
Fortran
2
star