mirror of
https://github.com/triqs/dft_tools
synced 2024-11-09 15:43:47 +01:00
819fc987f0
The files from the original vasp-interface repository are reshuffled in accord with the directory structure of dft_tools. Some of the directories, such as 'test' (unit tests for the interface), 'examples' (simple examples for the development purposes) are temporarily placed into 'python/vasp' directory to avoid confusion with integral tests and examples of dft_tools.
11 lines
137 B
Plaintext
11 lines
137 B
Plaintext
nq = 1
|
|
ntypes = 1
|
|
nions = [1]
|
|
el_names = ['V']
|
|
a_brav:
|
|
[[-1. 1. 1.]
|
|
[ 1. -1. 1.]
|
|
[ 1. 1. -1.]]
|
|
q_types:
|
|
[array([[ 0., 0., 0.]])]
|