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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 1026-1050 out of 2180
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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)
Username (user)
Volume of unit cell (volume)
Rows: 25
10
25
50
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200
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ID
✕
Formula
✕
1026
Au
8
Si
4
1027
Au
8
Si
4
1028
Au
8
Si
4
1029
Au
8
Si
4
1030
Au
8
Si
4
1031
Au
8
Si
4
1032
Au
8
Si
4
1033
Au
8
Si
4
1034
Au
8
Si
4
1035
Au
8
Si
4
1036
Au
8
Si
4
1037
Au
8
Si
4
1038
Au
8
Si
4
1039
Au
8
Si
4
1040
Au
8
Si
4
1041
Au
8
Si
4
1042
Au
8
Si
4
1043
Au
8
Si
4
1044
Au
8
Si
4
1045
Au
8
Si
4
1046
Au
8
Si
4
1047
Au
8
Si
4
1048
Au
8
Si
4
1049
Au
8
Si
4
1050
Au
8
Si
4
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