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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
ASE-calculator name (calculator)
Maximum force (fmax)
Chemical formula (formula)
Magnetic moment (magmom)
Sum of atomic masses in unit cell (mass)
Number of atoms (natoms)
Maximum stress on unit cell (smax)
Username (user)
Rows: 25
10
25
50
100
200
↓
ID
✕
Age
✕
Charge
✕
Si_rate
✕
Volume
✕
E
✕
Energy
✕
PBC
✕
2101
43M
0.000
0.364
2685.242
0.290
-81.788
TTT
2102
43M
0.000
0.364
2685.390
0.290
-81.790
TTT
2103
43M
0.000
0.364
2686.474
0.290
-81.790
TTT
2104
43M
0.000
0.364
2685.726
0.290
-81.794
TTT
2105
43M
0.000
0.364
2686.072
0.290
-81.779
TTT
2106
43M
0.000
0.364
2686.486
0.290
-81.780
TTT
2107
43M
0.000
0.364
2685.772
0.290
-81.792
TTT
2108
43M
0.000
0.364
2686.597
0.290
-81.779
TTT
2109
43M
0.000
0.364
2686.015
0.290
-81.779
TTT
2110
43M
0.000
0.364
2685.736
0.290
-81.791
TTT
2111
43M
0.000
0.364
2686.044
0.290
-81.785
TTT
2112
43M
0.000
0.364
2686.240
0.290
-81.780
TTT
2113
43M
0.000
0.364
2685.961
0.290
-81.776
TTT
2114
43M
0.000
0.364
2686.403
0.290
-81.779
TTT
2115
43M
0.000
0.364
2685.991
0.290
-81.791
TTT
2116
43M
0.000
0.364
2685.705
0.290
-81.789
TTT
2117
43M
0.000
0.364
2686.219
0.290
-81.778
TTT
2118
43M
0.000
0.364
2685.485
0.290
-81.788
TTT
2119
43M
0.000
0.364
2686.087
0.290
-81.776
TTT
2120
43M
0.000
0.364
2685.992
0.290
-81.791
TTT
2121
43M
0.000
0.364
2685.774
0.290
-81.792
TTT
2122
43M
0.000
0.364
2685.041
0.290
-81.789
TTT
2123
43M
0.000
0.364
2685.455
0.290
-81.793
TTT
2124
43M
0.000
0.364
2685.607
0.290
-81.790
TTT
2125
43M
0.000
0.364
2686.065
0.290
-81.779
TTT
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