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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 1176-1200 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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200
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ID
✕
Formula
✕
1176
Au
8
Si
4
1177
Au
8
Si
4
1178
Au
8
Si
4
1179
Au
8
Si
4
1180
Au
8
Si
4
1181
Au
8
Si
4
1182
Au
8
Si
4
1183
Au
8
Si
4
1184
Au
8
Si
4
1185
Au
8
Si
4
1186
Au
8
Si
4
1187
Au
8
Si
4
1188
Au
8
Si
4
1189
Au
8
Si
4
1190
Au
8
Si
4
1191
Au
8
Si
4
1192
Au
8
Si
4
1193
Au
8
Si
4
1194
Au
8
Si
4
1195
Au
8
Si
4
1196
Au
8
Si
4
1197
Au
8
Si
4
1198
Au
8
Si
4
1199
Au
8
Si
4
1200
Au
8
Si
4
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