abinit/tests/v5/Input/t53.abi

38 lines
587 B
Plaintext

t51o_DS21_DEN
4
2
2
-0.50 0.00 0.00
1.00 0.00 0.00
15
t53.outlin
1
5
t53.outden
1
1
1
0.0 0.0 0.0
1
1
2
0.25 0.25 0.25
0
#%%<BEGIN TEST_INFO>
#%% [setup]
#%% executable = cut3d
#%% test_chain = t51.abi, t52.abi, t53.abi
#%% [files]
#%% files_to_test =
#%% t53.stdout, tolnlines = 0, tolabs = 1.110e-14, tolrel = 4.584e-09
#%% [paral_info]
#%% max_nprocs = 1
#%% [extra_info]
#%% authors = Unknown
#%% keywords =
#%% description =
#%% Bismuth atom, isolated, in a supercell.
#%% Analyse the non-collinear spin-density obtained in test 51 , using cut3d
#%%<END TEST_INFO>