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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 1326-517 out of 517
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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)
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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200
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ID
✕
Formula
✕
Mass
✕
1326
Au
8
Si
4
1688.073
1327
Au
8
Si
4
1688.073
1328
Au
8
Si
4
1688.073
1329
Au
8
Si
4
1688.073
1330
Au
8
Si
4
1688.073
1331
Au
8
Si
4
1688.073
1332
Au
8
Si
4
1688.073
1333
Au
8
Si
4
1688.073
1334
Au
8
Si
4
1688.073
1335
Au
8
Si
4
1688.073
1336
Au
8
Si
4
1688.073
1337
Au
8
Si
4
1688.073
1338
Au
8
Si
4
1688.073
1339
Au
8
Si
4
1688.073
1340
Au
8
Si
4
1688.073
1341
Au
8
Si
4
1688.073
1342
Au
8
Si
4
1688.073
1343
Au
8
Si
4
1688.073
1344
Au
8
Si
4
1688.073
1345
Au
8
Si
4
1688.073
1346
Au
8
Si
4
1688.073
1347
Au
8
Si
4
1688.073
1348
Au
8
Si
4
1688.073
1349
Au
8
Si
4
1688.073
1350
Au
8
Si
4
1688.073
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