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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 1476-594 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
✕
1476
Au
8
Si
4
0.000
1477
Au
8
Si
4
0.000
1478
Au
8
Si
4
0.000
1479
Au
8
Si
4
0.000
1480
Au
8
Si
4
0.000
1481
Au
8
Si
4
0.000
1482
Au
8
Si
4
0.000
1483
Au
8
Si
4
0.000
1484
Au
8
Si
4
0.000
1485
Au
8
Si
4
0.000
1486
Au
8
Si
4
0.000
1487
Au
8
Si
4
0.000
1488
Au
8
Si
4
0.000
1489
Au
8
Si
4
0.000
1490
Au
8
Si
4
0.000
1491
Au
8
Si
4
0.000
1492
Au
8
Si
4
0.000
1493
Au
8
Si
4
0.000
1494
Au
8
Si
4
0.000
1495
Au
8
Si
4
0.000
1496
Au
8
Si
4
0.000
1497
Au
8
Si
4
0.000
1498
Au
8
Si
4
0.000
1499
Au
8
Si
4
0.000
1500
Au
8
Si
4
0.000
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