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Au_rate
E
Si_rate
age
Time since creation
calculator
ASE-calculator name
charge
Net charge in unit cell
|e|
energy
Total energy
eV
fmax
Maximum force
eV/Ang
formula
Chemical formula
id
Uniqe row ID
magmom
Magnetic moment
au
mass
Sum of atomic masses in unit cell
au
natoms
Number of atoms
pbc
Periodic boundary conditions
smax
Maximum stress on unit cell
eV/Ang
3
unique_id
Random (unique) ID
user
Username
volume
Volume of unit cell
Ang
3
Displaying rows 926-17 out of 17
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Au_rate
E
Si_rate
Time since creation (age)
ASE-calculator name (calculator)
Net charge in unit cell (charge)
Total energy (energy)
Maximum force (fmax)
Magnetic moment (magmom)
Sum of atomic masses in unit cell (mass)
Number of atoms (natoms)
Periodic boundary conditions (pbc)
Maximum stress on unit cell (smax)
Volume of unit cell (volume)
Rows: 25
10
25
50
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ID
✕
Formula
✕
Username
✕
926
Au
8
Si
4
yangxb
927
Au
8
Si
4
yangxb
928
Au
8
Si
4
yangxb
929
Au
8
Si
4
yangxb
930
Au
8
Si
4
yangxb
931
Au
8
Si
4
yangxb
932
Au
8
Si
4
yangxb
933
Au
8
Si
4
yangxb
934
Au
8
Si
4
yangxb
935
Au
8
Si
4
yangxb
936
Au
8
Si
4
yangxb
937
Au
8
Si
4
yangxb
938
Au
8
Si
4
yangxb
939
Au
8
Si
4
yangxb
940
Au
8
Si
4
yangxb
941
Au
8
Si
4
yangxb
942
Au
8
Si
4
yangxb
943
Au
8
Si
4
yangxb
944
Au
8
Si
4
yangxb
945
Au
8
Si
4
yangxb
946
Au
8
Si
4
yangxb
947
Au
8
Si
4
yangxb
948
Au
8
Si
4
yangxb
949
Au
8
Si
4
yangxb
950
Au
8
Si
4
yangxb
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