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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 1126-17 out of 17
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Au_rate
Si_rate
Time since creation (age)
ASE-calculator name (calculator)
Net charge in unit cell (charge)
Total energy (energy)
Maximum force (fmax)
Chemical formula (formula)
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
✕
E
✕
1126
0.245
1127
0.302
1128
0.247
1129
0.244
1130
0.244
1131
0.292
1132
0.244
1133
0.244
1134
0.291
1135
0.246
1136
0.246
1137
0.245
1138
0.246
1139
0.245
1140
0.290
1141
0.292
1142
0.245
1143
0.245
1144
0.244
1145
0.246
1146
0.292
1147
0.246
1148
0.247
1149
0.244
1150
0.245
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