no longer need this customization since switched to libxc-5.1.2 based benchmark

This commit is contained in:
Hsin-Yu Ko 2021-06-09 23:05:33 -04:00
parent b8fb2d231e
commit cdfba6d4eb
1 changed files with 0 additions and 8 deletions

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@ -69,14 +69,6 @@ inputs_args = ('vc-relax-scf-1.in' ,'1'), ('vc-relax-scf-2.in' ,'2')
program = PW
inputs_args = ('scf-dos-1.in' ,'1'), ('scf-dos-2.in' ,'2')
[cp_h2o_scan_libxc/]
program = CP
tolerance = ( (2.0e-5, 1.0e-5, 'e1'),
(4.0e-2, 2.0e-3, 's1'),
(3.5e-2, 1.0e-2, 'v1u'),
(1.0e-2, 1.0e-2, 'v1d'),
(6.0e-3, 1.0e-3, 't1') )
[ph_base/]
program = PH
inputs_args = ('c.scf.in', '1'), ('c.phG.in', '2'), ('ni.scf.in', '1'), ('ni.phX.in', '2'), ('si.scf.in', '1'), ('si.phG.in', '2'), ('si.phX.in', '2'), ('nipaw.scf.in', '1'), ('nipaw.phX.in', '2')