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