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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 326-350 out of 414
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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
✕
326
Au
16
Si
8
327
Au
16
Si
8
328
Au
16
Si
8
329
Au
16
Si
8
330
Au
16
Si
8
331
Au
16
Si
8
332
Au
16
Si
8
333
Au
16
Si
8
334
Au
16
Si
8
335
Au
16
Si
8
336
Au
16
Si
8
337
Au
16
Si
8
338
Au
16
Si
8
339
Au
16
Si
8
340
Au
16
Si
8
341
Au
16
Si
8
342
Au
16
Si
8
343
Au
16
Si
8
344
Au
16
Si
8
345
Au
16
Si
8
346
Au
16
Si
8
347
Au
16
Si
8
348
Au
16
Si
8
349
Au
16
Si
8
350
Au
16
Si
8
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