Home
SAGAR
Database
MATLAB-code
ASE database
Help with constructing advanced search queries ...
Toggle list of keys ...
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
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 76-100 out of 414
Download
Database file
JSON file
VASP file
last_column file
Convex Diagram
Add Column
ASE-calculator name (calculator)
Net charge in unit cell (charge)
Total energy (energy)
Maximum force (fmax)
Chemical formula (formula)
Magnetic moment (magmom)
Sum of atomic masses in unit cell (mass)
Number of atoms (natoms)
Periodic boundary conditions (pbc)
perms_num
Maximum stress on unit cell (smax)
Volume of unit cell (volume)
Rows: 25
10
25
50
100
200
↓
ID
✕
Username
✕
Age
✕
76
mse-gucc
53M
77
mse-gucc
53M
78
mse-gucc
53M
79
mse-gucc
53M
80
mse-gucc
53M
81
mse-gucc
53M
82
mse-gucc
53M
83
mse-gucc
53M
84
mse-gucc
53M
85
mse-gucc
53M
86
mse-gucc
53M
87
mse-gucc
53M
88
mse-gucc
53M
89
mse-gucc
53M
90
mse-gucc
53M
91
mse-gucc
53M
92
mse-gucc
53M
93
mse-gucc
53M
94
mse-gucc
53M
95
mse-gucc
53M
96
mse-gucc
53M
97
mse-gucc
53M
98
mse-gucc
53M
99
mse-gucc
53M
100
mse-gucc
53M
«
1
2
3
4
5
6
7
8
...
14
15
16
17
»