vasp - 标签 - Misaraty

vasp

2025

MD键长键角分析 06-26

2024

VASP+NEB 03-06

2021

HSE06计算态密度和能带 01-12

VASP固定基矢优化结构 01-11

态密度和能带联合作图 01-11

2020

the old and the new charge density differ 06-12

2019

吸收光谱 04-17

Phonopy声子谱 04-17

Bader电荷 04-17

差分电荷 04-17

VASP 04-17