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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 351-375 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
10
25
50
100
200
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ID
✕
Formula
✕
351
Au
16
Si
8
352
Au
16
Si
8
353
Au
16
Si
8
354
Au
16
Si
8
355
Au
16
Si
8
356
Au
16
Si
8
357
Au
16
Si
8
358
Au
16
Si
8
359
Au
16
Si
8
360
Au
16
Si
8
361
Au
16
Si
8
362
Au
16
Si
8
363
Au
16
Si
8
364
Au
16
Si
8
365
Au
16
Si
8
366
Au
16
Si
8
367
Au
16
Si
8
368
Au
16
Si
8
369
Au
16
Si
8
370
Au
16
Si
8
371
Au
16
Si
8
372
Au
16
Si
8
373
Au
16
Si
8
374
Au
16
Si
8
375
Au
16
Si
8
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