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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 1551-414 out of 414
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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
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ID
✕
Formula
✕
Username
✕
1551
Au
8
Si
4
yangxb
1552
Au
8
Si
4
yangxb
1553
Au
8
Si
4
yangxb
1554
Au
8
Si
4
yangxb
1555
Au
8
Si
4
yangxb
1556
Au
8
Si
4
yangxb
1557
Au
8
Si
4
yangxb
1558
Au
8
Si
4
yangxb
1559
Au
8
Si
4
yangxb
1560
Au
8
Si
4
yangxb
1561
Au
8
Si
4
yangxb
1562
Au
8
Si
4
yangxb
1563
Au
8
Si
4
yangxb
1564
Au
8
Si
4
yangxb
1565
Au
8
Si
4
yangxb
1566
Au
8
Si
4
yangxb
1567
Au
8
Si
4
yangxb
1568
Au
8
Si
4
yangxb
1569
Au
8
Si
4
yangxb
1570
Au
8
Si
4
yangxb
1571
Au
8
Si
4
yangxb
1572
Au
8
Si
4
yangxb
1573
Au
8
Si
4
yangxb
1574
Au
8
Si
4
yangxb
1575
Au
8
Si
4
yangxb
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