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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 651-17 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
✕
651
Au
10
Si
4
yangxb
652
Au
10
Si
4
yangxb
653
Au
10
Si
4
yangxb
654
Au
10
Si
4
yangxb
655
Au
10
Si
4
yangxb
656
Au
10
Si
4
yangxb
657
Au
10
Si
4
yangxb
658
Au
10
Si
4
yangxb
659
Au
10
Si
4
yangxb
660
Au
10
Si
4
yangxb
661
Au
10
Si
4
yangxb
662
Au
16
Si
8
yangxb
663
Au
16
Si
8
yangxb
664
Au
16
Si
8
yangxb
665
Au
16
Si
8
yangxb
666
Au
16
Si
8
yangxb
667
Au
16
Si
8
yangxb
668
Au
16
Si
8
yangxb
669
Au
16
Si
8
yangxb
670
Au
16
Si
8
yangxb
671
Au
16
Si
8
yangxb
672
Au
16
Si
8
yangxb
673
Au
16
Si
8
yangxb
674
Au
16
Si
8
yangxb
675
Au
16
Si
8
yangxb
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