vasp
6.1.1
19Jun20 (build Jun 25 2020 02:42:34) complex parallel
Lin64
2021 11 24
21:52:35
MWCNT (VASP-4)
0
Normal
Normal (blocked Davidson)
F
1
2
1
60
2
2
0.00001000
-0.02000000
100
2
1
400.00000000
0.77000000
Auto
1
0.20000000
1
F
F
4
Normal (blocked Davidson)
60
1
0.00001000
1
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F
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12.01100000
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F
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752
1
ion
element
atomtype
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C 1
C 1
C 1
C 1
C 1
C 1
C 1
C 1
type
atomspertype
element
mass
valence
pseudopotential
752C 12.01100000 4.00000000 PAW_PBE C 08Apr2002
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