GPUMD
v3.9.2
Main
Introduction
Installation
Theoretical background
Interatomic potentials
Tutorials
Interface
gpumd executable
Input files
Simulation protocol (
run.in
)
Simulation model (
model.xyz
)
Eigenvectors for modal analysis
Primitive cell (
basis.in
)
k-points (
kpoints.in
)
Input parameters
Output files
nep executable
Backmatter
Credits
Bibliography
Publications
Glossary
Index
GPUMD
source repo
|
gpumd.org
Eigenvectors for modal analysis
ΒΆ
Documentation
v: v3.9.2
Versions
latest release
development version