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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 1151-1175 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
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ID
✕
Formula
✕
1151
Au
8
Si
4
1152
Au
8
Si
4
1153
Au
8
Si
4
1154
Au
8
Si
4
1155
Au
8
Si
4
1156
Au
8
Si
4
1157
Au
8
Si
4
1158
Au
8
Si
4
1159
Au
8
Si
4
1160
Au
8
Si
4
1161
Au
8
Si
4
1162
Au
8
Si
4
1163
Au
8
Si
4
1164
Au
8
Si
4
1165
Au
8
Si
4
1166
Au
8
Si
4
1167
Au
8
Si
4
1168
Au
8
Si
4
1169
Au
8
Si
4
1170
Au
8
Si
4
1171
Au
8
Si
4
1172
Au
8
Si
4
1173
Au
8
Si
4
1174
Au
8
Si
4
1175
Au
8
Si
4
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