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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 1126-594 out of 594
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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
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200
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ID
✕
Formula
✕
Mass
✕
1126
Au
8
Si
4
1688.073
1127
Au
8
Si
4
1688.073
1128
Au
8
Si
4
1688.073
1129
Au
8
Si
4
1688.073
1130
Au
8
Si
4
1688.073
1131
Au
8
Si
4
1688.073
1132
Au
8
Si
4
1688.073
1133
Au
8
Si
4
1688.073
1134
Au
8
Si
4
1688.073
1135
Au
8
Si
4
1688.073
1136
Au
8
Si
4
1688.073
1137
Au
8
Si
4
1688.073
1138
Au
8
Si
4
1688.073
1139
Au
8
Si
4
1688.073
1140
Au
8
Si
4
1688.073
1141
Au
8
Si
4
1688.073
1142
Au
8
Si
4
1688.073
1143
Au
8
Si
4
1688.073
1144
Au
8
Si
4
1688.073
1145
Au
8
Si
4
1688.073
1146
Au
8
Si
4
1688.073
1147
Au
8
Si
4
1688.073
1148
Au
8
Si
4
1688.073
1149
Au
8
Si
4
1688.073
1150
Au
8
Si
4
1688.073
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