Skip to content
Snippets Groups Projects
Commit 2b1a0baf authored by dk2u09's avatar dk2u09
Browse files

fixed num atom / type

parent 51072242
Branches
No related tags found
No related merge requests found
...@@ -8,7 +8,7 @@ ...@@ -8,7 +8,7 @@
tprnfor = .true. tprnfor = .true.
/ /
&system &system
ibrav = 2, celldm(1) =6.73, nat= 1, ntyp= 1, ibrav = 2, celldm(1) =6.73, nat= 2, ntyp= 2,
ecutwfc = 25.0, ecutrho = 300.0 ecutwfc = 25.0, ecutrho = 300.0
occupations='smearing', smearing='gaussian', degauss=0.02 occupations='smearing', smearing='gaussian', degauss=0.02
/ /
......
0% Loading or .
You are about to add 0 people to the discussion. Proceed with caution.
Please register or to comment