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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 2076-2100 out of 2180
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Au_rate
E
Si_rate
Time since creation (age)
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)
Username (user)
Volume of unit cell (volume)
Rows: 25
10
25
50
100
200
↓
ID
✕
Calculator
✕
Maximum stress
✕
2076
vasp
0.001
2077
vasp
0.001
2078
vasp
0.001
2079
vasp
0.001
2080
vasp
0.001
2081
vasp
0.001
2082
vasp
0.001
2083
vasp
0.001
2084
vasp
0.001
2085
vasp
0.001
2086
vasp
0.001
2087
vasp
0.000
2088
vasp
0.001
2089
vasp
0.000
2090
vasp
0.000
2091
vasp
0.001
2092
vasp
0.001
2093
vasp
0.001
2094
vasp
0.001
2095
vasp
0.000
2096
vasp
0.000
2097
vasp
0.001
2098
vasp
0.001
2099
vasp
0.001
2100
vasp
0.001
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