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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 1526-517 out of 517
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Au_rate
E
Si_rate
Time since creation (age)
ASE-calculator name (calculator)
Total energy (energy)
Maximum force (fmax)
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
10
25
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200
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ID
✕
Formula
✕
Charge
✕
1526
Au
8
Si
4
0.000
1527
Au
8
Si
4
0.000
1528
Au
8
Si
4
0.000
1529
Au
8
Si
4
0.000
1530
Au
8
Si
4
0.000
1531
Au
8
Si
4
0.000
1532
Au
8
Si
4
0.000
1533
Au
8
Si
4
0.000
1534
Au
8
Si
4
0.000
1535
Au
8
Si
4
0.000
1536
Au
8
Si
4
0.000
1537
Au
8
Si
4
0.000
1538
Au
8
Si
4
0.000
1539
Au
8
Si
4
0.000
1540
Au
8
Si
4
0.000
1541
Au
8
Si
4
0.000
1542
Au
8
Si
4
0.000
1543
Au
8
Si
4
0.000
1544
Au
8
Si
4
0.000
1545
Au
8
Si
4
0.000
1546
Au
8
Si
4
0.000
1547
Au
8
Si
4
0.000
1548
Au
8
Si
4
0.000
1549
Au
8
Si
4
0.000
1550
Au
8
Si
4
0.000
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