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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 101-8 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)
Magnetic moment (magmom)
Number of atoms (natoms)
Periodic boundary conditions (pbc)
Volume of unit cell (volume)
Rows: 25
10
25
50
100
200
↓
ID
✕
Mass
✕
Maximum stress
✕
Energy
✕
Username
✕
101
17285.869
0.001
-59.682
yangxb
102
17285.869
0.001
-59.674
yangxb
103
17285.869
0.000
-59.675
yangxb
104
17285.869
0.001
-59.682
yangxb
105
17285.869
0.001
-59.671
yangxb
106
17285.869
0.000
-59.681
yangxb
107
17285.869
0.000
-59.683
yangxb
108
17285.869
0.001
-59.675
yangxb
109
17285.869
0.000
-59.673
yangxb
110
17285.869
0.001
-59.679
yangxb
111
17285.869
0.000
-59.682
yangxb
112
17285.869
0.001
-59.682
yangxb
113
17285.869
0.001
-59.682
yangxb
114
17285.869
0.000
-59.683
yangxb
115
17285.869
0.001
-59.682
yangxb
116
17285.869
0.001
-59.681
yangxb
117
17285.869
0.001
-59.670
yangxb
118
17285.869
0.001
-59.681
yangxb
119
17285.869
0.001
-59.679
yangxb
120
17285.869
0.001
-59.681
yangxb
121
17285.869
0.000
-59.682
yangxb
122
17285.869
0.001
-59.682
yangxb
123
17285.869
0.001
-59.683
yangxb
124
17285.869
0.001
-59.681
yangxb
125
17285.869
0.000
-43.735
yangxb
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