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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 1451-1475 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)
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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ID
✕
Formula
✕
1451
Au
8
Si
4
1452
Au
8
Si
4
1453
Au
8
Si
4
1454
Au
8
Si
4
1455
Au
8
Si
4
1456
Au
8
Si
4
1457
Au
8
Si
4
1458
Au
8
Si
4
1459
Au
8
Si
4
1460
Au
8
Si
4
1461
Au
8
Si
4
1462
Au
8
Si
4
1463
Au
8
Si
4
1464
Au
8
Si
4
1465
Au
8
Si
4
1466
Au
8
Si
4
1467
Au
8
Si
4
1468
Au
8
Si
4
1469
Au
8
Si
4
1470
Au
8
Si
4
1471
Au
8
Si
4
1472
Au
8
Si
4
1473
Au
8
Si
4
1474
Au
8
Si
4
1475
Au
8
Si
4
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