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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 1026-594 out of 594
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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)
Number of atoms (natoms)
Periodic boundary conditions (pbc)
Maximum stress on unit cell (smax)
Username (user)
Volume of unit cell (volume)
Rows: 25
10
25
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200
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ID
✕
Formula
✕
Mass
✕
1026
Au
8
Si
4
1688.073
1027
Au
8
Si
4
1688.073
1028
Au
8
Si
4
1688.073
1029
Au
8
Si
4
1688.073
1030
Au
8
Si
4
1688.073
1031
Au
8
Si
4
1688.073
1032
Au
8
Si
4
1688.073
1033
Au
8
Si
4
1688.073
1034
Au
8
Si
4
1688.073
1035
Au
8
Si
4
1688.073
1036
Au
8
Si
4
1688.073
1037
Au
8
Si
4
1688.073
1038
Au
8
Si
4
1688.073
1039
Au
8
Si
4
1688.073
1040
Au
8
Si
4
1688.073
1041
Au
8
Si
4
1688.073
1042
Au
8
Si
4
1688.073
1043
Au
8
Si
4
1688.073
1044
Au
8
Si
4
1688.073
1045
Au
8
Si
4
1688.073
1046
Au
8
Si
4
1688.073
1047
Au
8
Si
4
1688.073
1048
Au
8
Si
4
1688.073
1049
Au
8
Si
4
1688.073
1050
Au
8
Si
4
1688.073
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