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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 1801-594 out of 594
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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)
Username (user)
Volume of unit cell (volume)
Rows: 25
10
25
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ID
✕
Formula
✕
1801
Au
10
Si
4
1802
Au
10
Si
4
1803
Au
10
Si
4
1804
Au
10
Si
4
1805
Au
10
Si
4
1806
Au
10
Si
4
1807
Au
10
Si
4
1808
Au
10
Si
4
1809
Au
10
Si
4
1810
Au
10
Si
4
1811
Au
10
Si
4
1812
Au
10
Si
4
1813
Au
10
Si
4
1814
Au
10
Si
4
1815
Au
10
Si
4
1816
Au
10
Si
4
1817
Au
10
Si
4
1818
Au
10
Si
4
1819
Au
10
Si
4
1820
Au
10
Si
4
1821
Au
10
Si
4
1822
Au
10
Si
4
1823
Au
10
Si
4
1824
Au
10
Si
4
1825
Au
10
Si
4
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