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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 1726-31 out of 31
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Au_rate
E
Si_rate
Time since creation (age)
ASE-calculator name (calculator)
Net charge in unit cell (charge)
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)
Volume of unit cell (volume)
Rows: 25
10
25
50
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ID
✕
Formula
✕
Username
✕
1726
Au
10
Si
4
yangxb
1727
Au
10
Si
4
yangxb
1728
Au
10
Si
4
yangxb
1729
Au
10
Si
4
yangxb
1730
Au
10
Si
4
yangxb
1731
Au
10
Si
4
yangxb
1732
Au
10
Si
4
yangxb
1733
Au
10
Si
4
yangxb
1734
Au
10
Si
4
yangxb
1735
Au
10
Si
4
yangxb
1736
Au
10
Si
4
yangxb
1737
Au
10
Si
4
yangxb
1738
Au
10
Si
4
yangxb
1739
Au
10
Si
4
yangxb
1740
Au
10
Si
4
yangxb
1741
Au
10
Si
4
yangxb
1742
Au
10
Si
4
yangxb
1743
Au
10
Si
4
yangxb
1744
Au
10
Si
4
yangxb
1745
Au
10
Si
4
yangxb
1746
Au
10
Si
4
yangxb
1747
Au
10
Si
4
yangxb
1748
Au
10
Si
4
yangxb
1749
Au
10
Si
4
yangxb
1750
Au
10
Si
4
yangxb
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