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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 2101-2125 out of 2180
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Au_rate
E
Time since creation (age)
Net charge in unit cell (charge)
Maximum force (fmax)
Chemical formula (formula)
Uniqe row ID (id)
Magnetic moment (magmom)
Number of atoms (natoms)
Maximum stress on unit cell (smax)
Username (user)
Rows: 25
10
25
50
100
200
Calculator
✕
PBC
✕
Energy
✕
Volume
✕
Mass
✕
Si_rate
✕
vasp
TTT
-81.788
2685.242
17285.869
0.364
vasp
TTT
-81.790
2685.390
17285.869
0.364
vasp
TTT
-81.790
2686.474
17285.869
0.364
vasp
TTT
-81.794
2685.726
17285.869
0.364
vasp
TTT
-81.779
2686.072
17285.869
0.364
vasp
TTT
-81.780
2686.486
17285.869
0.364
vasp
TTT
-81.792
2685.772
17285.869
0.364
vasp
TTT
-81.779
2686.597
17285.869
0.364
vasp
TTT
-81.779
2686.015
17285.869
0.364
vasp
TTT
-81.791
2685.736
17285.869
0.364
vasp
TTT
-81.785
2686.044
17285.869
0.364
vasp
TTT
-81.780
2686.240
17285.869
0.364
vasp
TTT
-81.776
2685.961
17285.869
0.364
vasp
TTT
-81.779
2686.403
17285.869
0.364
vasp
TTT
-81.791
2685.991
17285.869
0.364
vasp
TTT
-81.789
2685.705
17285.869
0.364
vasp
TTT
-81.778
2686.219
17285.869
0.364
vasp
TTT
-81.788
2685.485
17285.869
0.364
vasp
TTT
-81.776
2686.087
17285.869
0.364
vasp
TTT
-81.791
2685.992
17285.869
0.364
vasp
TTT
-81.792
2685.774
17285.869
0.364
vasp
TTT
-81.789
2685.041
17285.869
0.364
vasp
TTT
-81.793
2685.455
17285.869
0.364
vasp
TTT
-81.790
2685.607
17285.869
0.364
vasp
TTT
-81.779
2686.065
17285.869
0.364
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