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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 2151-8 out of 8
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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)
Sum of atomic masses in unit cell (mass)
Number of atoms (natoms)
Username (user)
Volume of unit cell (volume)
Rows: 25
10
25
50
100
200
↓
ID
✕
Au_rate
✕
Maximum stress
✕
PBC
✕
Energy
✕
2151
0.714
0.001
TTT
-50.370
2152
0.714
0.001
TTT
-50.356
2153
0.714
0.001
TTT
-50.367
2154
0.714
0.000
TTT
-50.373
2155
0.714
0.001
TTT
-50.366
2156
0.714
0.000
TTT
-50.376
2157
0.714
0.001
TTT
-50.370
2158
0.714
0.000
TTT
-50.365
2159
0.714
0.001
TTT
-50.372
2160
0.714
0.000
TTT
-50.371
2161
0.714
0.001
TTT
-50.372
2162
0.714
0.001
TTT
-50.373
2163
0.714
0.000
TTT
-50.369
2164
0.714
0.000
TTT
-50.377
2165
0.714
0.001
TTT
-100.823
2166
0.714
0.001
TTT
-100.830
2167
0.714
0.000
TTT
-100.804
2168
0.714
0.000
TTT
-100.818
2169
0.714
0.000
TTT
-100.818
2170
0.714
0.000
TTT
-100.834
2171
0.714
0.001
TTT
-100.829
2172
0.714
0.000
TTT
-100.829
2173
0.714
0.000
TTT
-100.828
2174
0.714
0.000
TTT
-100.815
2175
0.714
0.000
TTT
-100.801
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