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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 1126-1150 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
✕
1126
Au
8
Si
4
1127
Au
8
Si
4
1128
Au
8
Si
4
1129
Au
8
Si
4
1130
Au
8
Si
4
1131
Au
8
Si
4
1132
Au
8
Si
4
1133
Au
8
Si
4
1134
Au
8
Si
4
1135
Au
8
Si
4
1136
Au
8
Si
4
1137
Au
8
Si
4
1138
Au
8
Si
4
1139
Au
8
Si
4
1140
Au
8
Si
4
1141
Au
8
Si
4
1142
Au
8
Si
4
1143
Au
8
Si
4
1144
Au
8
Si
4
1145
Au
8
Si
4
1146
Au
8
Si
4
1147
Au
8
Si
4
1148
Au
8
Si
4
1149
Au
8
Si
4
1150
Au
8
Si
4
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