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SAGAR
Database
MATLAB-code
ASE database
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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
perms_num
perms_number
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 101-31 out of 31
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Time since creation (age)
Net charge in unit cell (charge)
Total energy (energy)
Chemical formula (formula)
Magnetic moment (magmom)
Number of atoms (natoms)
Periodic boundary conditions (pbc)
perms_number
Username (user)
Volume of unit cell (volume)
Rows: 25
10
25
50
100
200
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ID
✕
Calculator
✕
Mass
✕
Maximum force
✕
Maximum stress
✕
101
unknown
17285.869
0.009
0.000
102
unknown
17285.869
0.217
0.000
103
unknown
17285.869
0.010
0.000
104
unknown
17285.869
0.009
0.000
105
unknown
17285.869
0.010
0.000
106
unknown
17285.869
0.010
0.000
107
unknown
17285.869
0.009
0.000
108
unknown
17285.869
0.009
0.000
109
unknown
17285.869
0.009
0.000
110
unknown
17285.869
0.009
0.000
111
unknown
17285.869
0.010
0.000
112
unknown
17285.869
0.010
0.000
113
unknown
17285.869
0.010
0.000
114
unknown
17285.869
0.007
0.000
115
unknown
17285.869
0.010
0.000
116
unknown
17285.869
0.009
0.000
117
unknown
17285.869
0.008
0.000
118
unknown
17285.869
0.009
0.000
119
unknown
17285.869
0.009
0.000
120
unknown
17285.869
0.009
0.000
121
unknown
17285.869
0.010
0.000
122
unknown
17285.869
0.008
0.000
123
unknown
17285.869
0.009
0.000
124
unknown
17285.869
0.007
0.000
125
unknown
17285.869
0.009
0.000
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