Skip to content

Commit 1f16da1

Browse files
author
dyzheng
committed
add test case for restart_dm
1 parent 9912b71 commit 1f16da1

3 files changed

Lines changed: 64 additions & 9 deletions

File tree

tests/03_NAO_multik/02_NO_KP_15/INPUT

Lines changed: 4 additions & 1 deletion
Original file line numberDiff line numberDiff line change
@@ -4,7 +4,7 @@ suffix autotest
44
calculation scf
55

66
nbands 6
7-
symmetry 1
7+
symmetry 0
88
pseudo_dir ../../PP_ORB
99
orbital_dir ../../PP_ORB
1010
gamma_only 0
@@ -21,6 +21,9 @@ basis_type lcao
2121
#Parameters (4.Smearing)
2222
smearing_method gauss
2323
smearing_sigma 0.002
24+
init_chg dm
25+
#out_dmr 1
26+
read_file_dir ./
2427

2528
#Parameters (5.Mixing)
2629
mixing_type broyden

0 commit comments

Comments
 (0)