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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 1576-594 out of 594
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Au_rate
E
Si_rate
Time since creation (age)
ASE-calculator name (calculator)
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)
Username (user)
Volume of unit cell (volume)
Rows: 25
10
25
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200
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ID
✕
Formula
✕
Charge
✕
1576
Au
8
Si
4
0.000
1577
Au
8
Si
4
0.000
1578
Au
8
Si
4
0.000
1579
Au
8
Si
4
0.000
1580
Au
8
Si
4
0.000
1581
Au
8
Si
4
0.000
1582
Au
8
Si
4
0.000
1583
Au
8
Si
4
0.000
1584
Au
8
Si
4
0.000
1585
Au
8
Si
4
0.000
1586
Au
8
Si
4
0.000
1587
Au
8
Si
4
0.000
1588
Au
8
Si
4
0.000
1589
Au
8
Si
4
0.000
1590
Au
8
Si
4
0.000
1591
Au
8
Si
4
0.000
1592
Au
8
Si
4
0.000
1593
Au
8
Si
4
0.000
1594
Au
8
Si
4
0.000
1595
Au
8
Si
4
0.000
1596
Au
8
Si
4
0.000
1597
Au
8
Si
4
0.000
1598
Au
8
Si
4
0.000
1599
Au
8
Si
4
0.000
1600
Au
8
Si
4
0.000
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