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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 751-594 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)
Volume of unit cell (volume)
Rows: 25
10
25
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ID
✕
Formula
✕
Username
✕
751
Au
8
Si
4
yangxb
752
Au
8
Si
4
yangxb
753
Au
8
Si
4
yangxb
754
Au
8
Si
4
yangxb
755
Au
8
Si
4
yangxb
756
Au
8
Si
4
yangxb
757
Au
8
Si
4
yangxb
758
Au
8
Si
4
yangxb
759
Au
8
Si
4
yangxb
760
Au
8
Si
4
yangxb
761
Au
8
Si
4
yangxb
762
Au
8
Si
4
yangxb
763
Au
8
Si
4
yangxb
764
Au
8
Si
4
yangxb
765
Au
8
Si
4
yangxb
766
Au
8
Si
4
yangxb
767
Au
8
Si
4
yangxb
768
Au
8
Si
4
yangxb
769
Au
8
Si
4
yangxb
770
Au
8
Si
4
yangxb
771
Au
8
Si
4
yangxb
772
Au
8
Si
4
yangxb
773
Au
8
Si
4
yangxb
774
Au
8
Si
4
yangxb
775
Au
8
Si
4
yangxb
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