abinit/tests/v9/Input/t101.abi

29 lines
1.1 KiB
Plaintext

2 # flag for PAW run conducti
t100o
0.073119 0.0000001 5.00 1000 1 # delta_freq, min_freq, max_freq(in atomic units), nfreq, iatom
#%%<BEGIN TEST_INFO>
#%% [setup]
#%% executable = conducti
#%% test_chain = t100.abi, t101.abi
#%% [files]
#%% files_to_test =
#%% t101.out, tolnlines =10, tolabs = 6.5e-05, tolrel = 2.2e-05, fld_options = -easy;
#%% t101_Kth, tolnlines =50, tolabs = 6.5e-05, tolrel = 2.2e-05, fld_options = -easy;
#%% t101_abs, tolnlines =50, tolabs = 4.0e+04, tolrel = 3.2e-05, fld_options = -ridiculous;
#%% t101_eps, tolnlines = 50, tolabs = 1.1e-07, tolrel = 1.9e-08, fld_options = -easy;
#%% t101_Lij, tolnlines = 50, tolabs = 1.1e-07, tolrel = 1.9e-08, fld_options = -ridiculous;
#%% t101_sig, tolnlines = 50, tolabs = 1.1e-07, tolrel = 1.9e-08, fld_options = -easy;
#%% extra_inputs =
#%% [paral_info]
#%% max_nprocs = 1
#%% [extra_info]
#%% authors = N. Brouwer, M. Torrent
#%% keywords =
#%% description =
#%% Tests a PAW conductivity calculation.
#%% It tests the following parts of the code:
#%% conducti, conducti_paw
#%%<END TEST_INFO>