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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 176-8 out of 8
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Au_rate
E
Si_rate
Time since creation (age)
ASE-calculator name (calculator)
Net charge in unit cell (charge)
Maximum force (fmax)
Chemical formula (formula)
Uniqe row ID (id)
Magnetic moment (magmom)
Number of atoms (natoms)
Periodic boundary conditions (pbc)
Rows: 25
10
25
50
100
200
Mass
✕
Maximum stress
✕
Energy
✕
Username
✕
Volume
✕
17285.869
0.001
-43.767
yangxb
1443.861
17285.869
0.001
-43.749
yangxb
1437.956
17285.869
0.001
-44.350
yangxb
1426.074
17285.869
0.001
-44.349
yangxb
1425.617
17285.869
0.001
-43.777
yangxb
1444.530
17285.869
0.001
-43.756
yangxb
1438.041
17285.869
0.001
-43.783
yangxb
1443.714
17285.869
0.001
-43.654
yangxb
1443.376
17285.869
0.001
-43.789
yangxb
1443.844
17285.869
0.001
-44.357
yangxb
1426.518
17285.869
0.000
-43.749
yangxb
1438.460
17285.869
0.001
-44.353
yangxb
1426.111
17285.869
0.001
-43.770
yangxb
1445.776
17285.869
0.001
-43.796
yangxb
1443.943
17285.869
0.001
-43.977
yangxb
1441.381
17285.869
0.001
-43.756
yangxb
1438.664
17285.869
0.001
-44.357
yangxb
1426.604
17285.869
0.001
-44.351
yangxb
1425.321
17285.869
0.001
-44.354
yangxb
1427.002
17285.869
0.001
-43.746
yangxb
1438.226
17285.869
0.001
-44.365
yangxb
1426.595
17285.869
0.001
-43.791
yangxb
1444.357
17285.869
0.001
-43.749
yangxb
1438.419
17285.869
0.001
-44.344
yangxb
1425.182
17285.869
0.001
-44.344
yangxb
1426.366
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