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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 1201-414 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)
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
↓
ID
✕
Formula
✕
Mass
✕
1201
Au
8
Si
4
1688.073
1202
Au
8
Si
4
1688.073
1203
Au
8
Si
4
1688.073
1204
Au
8
Si
4
1688.073
1205
Au
8
Si
4
1688.073
1206
Au
8
Si
4
1688.073
1207
Au
8
Si
4
1688.073
1208
Au
8
Si
4
1688.073
1209
Au
8
Si
4
1688.073
1210
Au
8
Si
4
1688.073
1211
Au
8
Si
4
1688.073
1212
Au
8
Si
4
1688.073
1213
Au
8
Si
4
1688.073
1214
Au
8
Si
4
1688.073
1215
Au
8
Si
4
1688.073
1216
Au
8
Si
4
1688.073
1217
Au
8
Si
4
1688.073
1218
Au
8
Si
4
1688.073
1219
Au
8
Si
4
1688.073
1220
Au
8
Si
4
1688.073
1221
Au
8
Si
4
1688.073
1222
Au
8
Si
4
1688.073
1223
Au
8
Si
4
1688.073
1224
Au
8
Si
4
1688.073
1225
Au
8
Si
4
1688.073
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