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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 1226-1250 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
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ID
✕
Formula
✕
1226
Au
8
Si
4
1227
Au
8
Si
4
1228
Au
8
Si
4
1229
Au
8
Si
4
1230
Au
8
Si
4
1231
Au
8
Si
4
1232
Au
8
Si
4
1233
Au
8
Si
4
1234
Au
8
Si
4
1235
Au
8
Si
4
1236
Au
8
Si
4
1237
Au
8
Si
4
1238
Au
8
Si
4
1239
Au
8
Si
4
1240
Au
8
Si
4
1241
Au
8
Si
4
1242
Au
8
Si
4
1243
Au
8
Si
4
1244
Au
8
Si
4
1245
Au
8
Si
4
1246
Au
8
Si
4
1247
Au
8
Si
4
1248
Au
8
Si
4
1249
Au
8
Si
4
1250
Au
8
Si
4
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