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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 576-8 out of 8
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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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200
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ID
✕
Formula
✕
Username
✕
576
Au
10
Si
4
yangxb
577
Au
10
Si
4
yangxb
578
Au
10
Si
4
yangxb
579
Au
10
Si
4
yangxb
580
Au
10
Si
4
yangxb
581
Au
10
Si
4
yangxb
582
Au
10
Si
4
yangxb
583
Au
10
Si
4
yangxb
584
Au
10
Si
4
yangxb
585
Au
10
Si
4
yangxb
586
Au
10
Si
4
yangxb
587
Au
10
Si
4
yangxb
588
Au
10
Si
4
yangxb
589
Au
10
Si
4
yangxb
590
Au
10
Si
4
yangxb
591
Au
10
Si
4
yangxb
592
Au
10
Si
4
yangxb
593
Au
10
Si
4
yangxb
594
Au
10
Si
4
yangxb
595
Au
10
Si
4
yangxb
596
Au
10
Si
4
yangxb
597
Au
10
Si
4
yangxb
598
Au
10
Si
4
yangxb
599
Au
8
Si
4
yangxb
600
Au
8
Si
4
yangxb
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