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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 1326-1350 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
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25
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ID
✕
Formula
✕
1326
Au
8
Si
4
1327
Au
8
Si
4
1328
Au
8
Si
4
1329
Au
8
Si
4
1330
Au
8
Si
4
1331
Au
8
Si
4
1332
Au
8
Si
4
1333
Au
8
Si
4
1334
Au
8
Si
4
1335
Au
8
Si
4
1336
Au
8
Si
4
1337
Au
8
Si
4
1338
Au
8
Si
4
1339
Au
8
Si
4
1340
Au
8
Si
4
1341
Au
8
Si
4
1342
Au
8
Si
4
1343
Au
8
Si
4
1344
Au
8
Si
4
1345
Au
8
Si
4
1346
Au
8
Si
4
1347
Au
8
Si
4
1348
Au
8
Si
4
1349
Au
8
Si
4
1350
Au
8
Si
4
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