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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 1476-1500 out of 2180
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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)
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
50
100
200
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ID
✕
Formula
✕
Maximum force
✕
1476
Au
8
Si
4
0.018
1477
Au
8
Si
4
0.015
1478
Au
8
Si
4
0.006
1479
Au
8
Si
4
0.042
1480
Au
8
Si
4
0.010
1481
Au
8
Si
4
0.015
1482
Au
8
Si
4
0.022
1483
Au
8
Si
4
0.008
1484
Au
8
Si
4
0.020
1485
Au
8
Si
4
0.006
1486
Au
8
Si
4
0.011
1487
Au
8
Si
4
0.010
1488
Au
8
Si
4
0.010
1489
Au
8
Si
4
0.016
1490
Au
8
Si
4
0.224
1491
Au
8
Si
4
0.012
1492
Au
8
Si
4
0.008
1493
Au
8
Si
4
0.007
1494
Au
8
Si
4
0.008
1495
Au
8
Si
4
0.493
1496
Au
8
Si
4
0.039
1497
Au
8
Si
4
0.043
1498
Au
8
Si
4
0.051
1499
Au
8
Si
4
0.059
1500
Au
8
Si
4
0.020
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