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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 1576-517 out of 517
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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
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25
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ID
✕
Formula
✕
Username
✕
1576
Au
8
Si
4
yangxb
1577
Au
8
Si
4
yangxb
1578
Au
8
Si
4
yangxb
1579
Au
8
Si
4
yangxb
1580
Au
8
Si
4
yangxb
1581
Au
8
Si
4
yangxb
1582
Au
8
Si
4
yangxb
1583
Au
8
Si
4
yangxb
1584
Au
8
Si
4
yangxb
1585
Au
8
Si
4
yangxb
1586
Au
8
Si
4
yangxb
1587
Au
8
Si
4
yangxb
1588
Au
8
Si
4
yangxb
1589
Au
8
Si
4
yangxb
1590
Au
8
Si
4
yangxb
1591
Au
8
Si
4
yangxb
1592
Au
8
Si
4
yangxb
1593
Au
8
Si
4
yangxb
1594
Au
8
Si
4
yangxb
1595
Au
8
Si
4
yangxb
1596
Au
8
Si
4
yangxb
1597
Au
8
Si
4
yangxb
1598
Au
8
Si
4
yangxb
1599
Au
8
Si
4
yangxb
1600
Au
8
Si
4
yangxb
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