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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 826-17 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
✕
826
Au
8
Si
4
yangxb
827
Au
8
Si
4
yangxb
828
Au
8
Si
4
yangxb
829
Au
8
Si
4
yangxb
830
Au
8
Si
4
yangxb
831
Au
8
Si
4
yangxb
832
Au
8
Si
4
yangxb
833
Au
8
Si
4
yangxb
834
Au
8
Si
4
yangxb
835
Au
8
Si
4
yangxb
836
Au
8
Si
4
yangxb
837
Au
8
Si
4
yangxb
838
Au
8
Si
4
yangxb
839
Au
8
Si
4
yangxb
840
Au
8
Si
4
yangxb
841
Au
8
Si
4
yangxb
842
Au
8
Si
4
yangxb
843
Au
8
Si
4
yangxb
844
Au
8
Si
4
yangxb
845
Au
8
Si
4
yangxb
846
Au
8
Si
4
yangxb
847
Au
8
Si
4
yangxb
848
Au
8
Si
4
yangxb
849
Au
8
Si
4
yangxb
850
Au
8
Si
4
yangxb
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