ASE database

Displaying rows 1-31 out of 31

↓ ID ✕	Formula ✕	perms_num ✕
1	C₆₀H₁₈	1
2	C₆₀H₁₈	1
3	C₆₀H₁₈	1
4	C₆₀H₁₈	1
5	C₆₀H₁₈	1
6	C₆₀H₁₈	1
7	C₆₀H₁₈	1
8	C₆₀H₁₈	1
9	C₆₀H₁₈	2
10	C₆₀H₁₈	2
11	C₆₀H₁₈	1
12	C₆₀H₁₈	1
13	C₆₀H₁₈	1
14	C₆₀H₁₈	1
15	C₆₀H₁₈	1
16	C₆₀H₁₈	1
17	C₆₀H₁₈	2
18	C₆₀H₁₈	2
19	C₆₀H₁₈	1
20	C₆₀H₁₈	1
21	C₆₀H₁₈	1
22	C₆₀H₁₈	1
23	C₆₀H₁₈	1
24	C₆₀H₁₈	2
25	C₆₀H₁₈	1
26	C₆₀H₁₈	1
27	C₆₀H₁₈	1
28	C₆₀H₁₈	2
29	C₆₀H₁₈	1
30	C₆₀H₁₈	2
31	C₆₀H₁₈	1
32	C₆₀H₁₈	2
33	C₆₀H₁₈	1
34	C₆₀H₁₈	1
35	C₆₀H₁₈	1
36	C₆₀H₁₈	1
37	C₆₀H₁₈	1
38	C₆₀H₁₈	2
39	C₆₀H₁₈	2
40	C₆₀H₁₈	2
41	C₆₀H₁₈	2
42	C₆₀H₁₈	1
43	C₆₀H₁₈	2
44	C₆₀H₁₈	1
45	C₆₀H₁₈	1
46	C₆₀H₁₈	2
47	C₆₀H₁₈	1
48	C₆₀H₁₈	2
49	C₆₀H₁₈	2
50	C₆₀H₁₈	2
51	C₆₀H₁₈	2
52	C₆₀H₁₈	1
53	C₆₀H₁₈	2
54	C₆₀H₁₈	2
55	C₆₀H₁₈	2
56	C₆₀H₁₈	2
57	C₆₀H₁₈	1
58	C₆₀H₁₈	2
59	C₆₀H₁₈	1
60	C₆₀H₁₈	2
61	C₆₀H₁₈	1
62	C₆₀H₁₈	2
63	C₆₀H₁₈	1
64	C₆₀H₁₈	2
65	C₆₀H₁₈	2
66	C₆₀H₁₈	1
67	C₆₀H₁₈	1
68	C₆₀H₁₈	2
69	C₆₀H₁₈	1
70	C₆₀H₁₈	2
71	C₆₀H₁₈	2
72	C₆₀H₁₈	1
73	C₆₀H₁₈	2
74	C₆₀H₁₈	1
75	C₆₀H₁₈	1
76	C₆₀H₁₈	2
77	C₆₀H₁₈	2
78	C₆₀H₁₈	1
79	C₆₀H₁₈	1
80	C₆₀H₁₈	2
81	C₆₀H₁₈	2
82	C₆₀H₁₈	1
83	C₆₀H₁₈	2
84	C₆₀H₁₈	1
85	C₆₀H₁₈	2
86	C₆₀H₁₈	2
87	C₆₀H₁₈	1
88	C₆₀H₁₈	1
89	C₆₀H₁₈	2
90	C₆₀H₁₈	1
91	C₆₀H₁₈	2
92	C₆₀H₁₈	2
93	C₆₀H₁₈	1
94	C₆₀H₁₈	2
95	C₆₀H₁₈	1
96	C₆₀H₁₈	2
97	C₆₀H₁₈	1
98	C₆₀H₁₈	2
99	C₆₀H₁₈	1
100	C₆₀H₁₈	2

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/Ang³
unique_id	Random (unique) ID
user	Username
volume	Volume of unit cell	Ang³