vasp
6.1.1
19Jun20 (build Jun 25 2020 02:42:34) complex parallel
Lin64
2022 04 07
10:09:49
No title
0
Normal
Normal (blocked Davidson)
F
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60
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103
4
ion
element
atomtype
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
Ru 1
O 2
O 2
O 2
O 2
S 3
H 4
H 4
type
atomspertype
element
mass
valence
pseudopotential
96Ru 101.07000000 14.00000000 PAW_PBE Ru_pv 28Jan2005
4O 16.00000000 6.00000000 PAW_PBE O 08Apr2002
1S 32.06600000 6.00000000 PAW_PBE S 06Sep2000
2H 1.00000000 1.00000000 PAW_PBE H 15Jun2001
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