ASE database - Search

↓ ID ✕	Volume ✕	plane_index ✕	PBC ✕	Age ✕	atom_E ✕
26	2654.442	100	TTT	15M	-1.533
27	2654.442	100	TTT	15M	-0.424
28	2654.442	100	TTT	15M	-0.013
29	2654.442	100	TTT	15M	-0.225
30	2654.442	100	TTT	15M	-0.004
31	2654.442	100	TTT	15M	-0.295
32	2654.442	100	TTT	15M	-0.830
33	2654.442	100	TTT	15M	-1.888
34	2654.442	100	TTT	15M	-0.945
35	2654.442	100	TTT	15M	-0.243
36	2654.442	100	TTT	15M	-0.025
37	2654.442	100	TTT	15M	-1.117
38	2654.442	100	TTT	15M	0.002
39	2654.442	100	TTT	15M	-0.299
40	2654.442	100	TTT	15M	-0.039
41	2654.442	100	TTT	15M	-0.349
42	2654.442	100	TTT	15M	-1.248
43	2654.442	100	TTT	15M	-3.124
44	2654.442	100	TTT	15M	-1.533
45	2654.442	100	TTT	15M	-0.424
46	2654.442	100	TTT	15M	-0.013
47	2654.442	100	TTT	15M	-0.225
48	2654.442	100	TTT	15M	-0.004
49	2654.442	100	TTT	15M	-0.295
50	2654.442	100	TTT	15M	-0.830

Dipole_val
ads_E
ads_site
age	Time since creation
atom_E
calculator	ASE-calculator name
charge	Net charge in unit cell	\|e\|
distance
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
plane_index
slab_E
smax	Maximum stress on unit cell	eV/Ang³
str_E
unique_id	Random (unique) ID
user	Username
volume	Volume of unit cell	Ang³