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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 1426-1450 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)
Volume of unit cell (volume)
Rows: 25
10
25
50
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↓
ID
✕
Formula
✕
Username
✕
1426
Au
8
Si
4
yangxb
1427
Au
8
Si
4
yangxb
1428
Au
8
Si
4
yangxb
1429
Au
8
Si
4
yangxb
1430
Au
8
Si
4
yangxb
1431
Au
8
Si
4
yangxb
1432
Au
8
Si
4
yangxb
1433
Au
8
Si
4
yangxb
1434
Au
8
Si
4
yangxb
1435
Au
8
Si
4
yangxb
1436
Au
8
Si
4
yangxb
1437
Au
8
Si
4
yangxb
1438
Au
8
Si
4
yangxb
1439
Au
8
Si
4
yangxb
1440
Au
8
Si
4
yangxb
1441
Au
8
Si
4
yangxb
1442
Au
8
Si
4
yangxb
1443
Au
8
Si
4
yangxb
1444
Au
8
Si
4
yangxb
1445
Au
8
Si
4
yangxb
1446
Au
8
Si
4
yangxb
1447
Au
8
Si
4
yangxb
1448
Au
8
Si
4
yangxb
1449
Au
8
Si
4
yangxb
1450
Au
8
Si
4
yangxb
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