ASE database - Search

Displaying rows 1-8 out of 8

↓ ID ✕	Formula ✕	Maximum force ✕
1	C₆₀H₃₆	0.008
2	C₆₀H₃₆	0.009
3	C₆₀H₃₆	0.009
4	C₆₀H₃₆	0.007
5	C₆₀H₃₆	0.010
6	C₆₀H₃₆	0.008
7	C₆₀H₃₆	0.009
8	C₆₀H₃₆	0.007
9	C₆₀H₃₆	0.009
10	C₆₀H₃₆	0.009
11	C₆₀H₃₆	0.009
12	C₆₀H₃₆	0.007
13	C₆₀H₃₆	0.010
14	C₆₀H₃₆	0.009
15	C₆₀H₃₆	0.008
16	C₆₀H₃₆	0.009
17	C₆₀H₃₆	0.009
18	C₆₀H₃₆	0.010
19	C₆₀H₃₆	0.009
20	C₆₀H₃₆	0.009
21	C₆₀H₃₆	0.008
22	C₆₀H₃₆	0.010
23	C₆₀H₃₆	0.009
24	C₆₀H₃₆	0.035
25	C₆₀H₃₆	0.010
26	C₆₀H₃₆	0.006
27	C₆₀H₃₆	0.008
28	C₆₀H₃₆	0.008
29	C₆₀H₃₆	0.009
30	C₆₀H₃₆	0.009
31	C₆₀H₃₆	0.007
32	C₆₀H₃₆	0.009
33	C₆₀H₃₆	0.010
34	C₆₀H₃₆	0.010
35	C₆₀H₃₆	0.010
36	C₆₀H₃₆	0.007
37	C₆₀H₃₆	0.009
38	C₆₀H₃₆	0.008
39	C₆₀H₃₆	0.010
40	C₆₀H₃₆	0.009
41	C₆₀H₃₆	0.008
42	C₆₀H₃₆	0.011
43	C₆₀H₃₆	0.008
44	C₆₀H₃₆	0.007
45	C₆₀H₃₆	0.008
46	C₆₀H₃₆	0.010
47	C₆₀H₃₆	0.009
48	C₆₀H₃₆	0.010
49	C₆₀H₃₆	0.009
50	C₆₀H₃₆	0.008
51	C₆₀H₃₆	0.007
52	C₆₀H₃₆	0.009
53	C₆₀H₃₆	0.009
54	C₆₀H₃₆	0.009
55	C₆₀H₃₆	0.009
56	C₆₀H₃₆	0.009
57	C₆₀H₃₆	0.009
58	C₆₀H₃₆	0.008
59	C₆₀H₃₆	0.007
60	C₆₀H₃₆	0.008
61	C₆₀H₃₆	0.010
62	C₆₀H₃₆	0.009
63	C₆₀H₃₆	0.010
64	C₆₀H₃₆	0.010
65	C₆₀H₃₆	0.010
66	C₆₀H₃₆	0.008
67	C₆₀H₃₆	0.009
68	C₆₀H₃₆	0.046
69	C₆₀H₃₆	0.009
70	C₆₀H₃₆	0.008
71	C₆₀H₃₆	0.008
72	C₆₀H₃₆	0.009
73	C₆₀H₃₆	0.009
74	C₆₀H₃₆	0.008
75	C₆₀H₃₆	0.010
76	C₆₀H₃₆	0.008
77	C₆₀H₃₆	0.008
78	C₆₀H₃₆	0.010
79	C₆₀H₃₆	0.009
80	C₆₀H₃₆	0.009
81	C₆₀H₃₆	0.006
82	C₆₀H₃₆	0.010
83	C₆₀H₃₆	0.008
84	C₆₀H₃₆	0.009
85	C₆₀H₃₆	0.008
86	C₆₀H₃₆	0.010
87	C₆₀H₃₆	0.009
88	C₆₀H₃₆	0.008
89	C₆₀H₃₆	0.010
90	C₆₀H₃₆	0.009
91	C₆₀H₃₆	0.009
92	C₆₀H₃₆	0.009
93	C₆₀H₃₆	0.009
94	C₆₀H₃₆	0.010
95	C₆₀H₃₆	0.010
96	C₆₀H₃₆	0.009
97	C₆₀H₃₆	0.008
98	C₆₀H₃₆	0.007
99	C₆₀H₃₆	0.010
100	C₆₀H₃₆	0.007
101	C₆₀H₃₆	0.009
102	C₆₀H₃₆	0.217
103	C₆₀H₃₆	0.010
104	C₆₀H₃₆	0.009
105	C₆₀H₃₆	0.010
106	C₆₀H₃₆	0.010
107	C₆₀H₃₆	0.009
108	C₆₀H₃₆	0.009
109	C₆₀H₃₆	0.009
110	C₆₀H₃₆	0.009
111	C₆₀H₃₆	0.010
112	C₆₀H₃₆	0.010
113	C₆₀H₃₆	0.010
114	C₆₀H₃₆	0.007
115	C₆₀H₃₆	0.010
116	C₆₀H₃₆	0.009
117	C₆₀H₃₆	0.008
118	C₆₀H₃₆	0.009
119	C₆₀H₃₆	0.009
120	C₆₀H₃₆	0.009
121	C₆₀H₃₆	0.010
122	C₆₀H₃₆	0.008
123	C₆₀H₃₆	0.009
124	C₆₀H₃₆	0.007
125	C₆₀H₃₆	0.009
126	C₆₀H₃₆	0.008
127	C₆₀H₃₆	0.010
128	C₆₀H₃₆	0.009
129	C₆₀H₃₆	0.009
130	C₆₀H₃₆	0.010
131	C₆₀H₃₆	0.009
132	C₆₀H₃₆	0.010
133	C₆₀H₃₆	0.009
134	C₆₀H₃₆	0.009
135	C₆₀H₃₆	0.009
136	C₆₀H₃₆	0.009
137	C₆₀H₃₆	0.009
138	C₆₀H₃₆	0.008
139	C₆₀H₃₆	0.010
140	C₆₀H₃₆	0.010
141	C₆₀H₃₆	0.010
142	C₆₀H₃₆	0.009
143	C₆₀H₃₆	0.039
144	C₆₀H₃₆	0.008
145	C₆₀H₃₆	0.009
146	C₆₀H₃₆	0.008
147	C₆₀H₃₆	0.009
148	C₆₀H₃₆	0.007
149	C₆₀H₃₆	0.008
150	C₆₀H₃₆	0.007
151	C₆₀H₃₆	0.008
152	C₆₀H₃₆	0.010
153	C₆₀H₃₆	0.008
154	C₆₀H₃₆	0.011
155	C₆₀H₃₆	0.009
156	C₆₀H₃₆	0.009
157	C₆₀H₃₆	0.189
158	C₆₀H₃₆	0.010
159	C₆₀H₃₆	0.014
160	C₆₀H₃₆	0.008
161	C₆₀H₃₆	0.012
162	C₆₀H₃₆	0.027
163	C₆₀H₃₆	0.010
164	C₆₀H₃₆	0.010
165	C₆₀H₃₆	0.081
166	C₆₀H₃₆	0.040
167	C₆₀H₃₆	0.012
168	C₆₀H₃₆	0.010
169	C₆₀H₃₆	0.009
170	C₆₀H₃₆	0.011
171	C₆₀H₃₆	0.023
172	C₆₀H₃₆	0.270
173	C₆₀H₃₆	0.010
174	C₆₀H₃₆	0.031
175	C₆₀H₃₆	0.014
176	C₆₀H₃₆	0.127
177	C₆₀H₃₆	0.008
178	C₆₀H₃₆	0.017
179	C₆₀H₃₆	0.010
180	C₆₀H₃₆	0.032
181	C₆₀H₃₆	0.019
182	C₆₀H₃₆	0.010
183	C₆₀H₃₆	0.052
184	C₆₀H₃₆	0.600
185	C₆₀H₃₆	0.137
186	C₆₀H₃₆	0.073
187	C₆₀H₃₆	0.010
188	C₆₀H₃₆	0.025
189	C₆₀H₃₆	0.009
190	C₆₀H₃₆	0.014
191	C₆₀H₃₆	0.009
192	C₆₀H₃₆	0.020
193	C₆₀H₃₆	0.015
194	C₆₀H₃₆	0.008
195	C₆₀H₃₆	0.034
196	C₆₀H₃₆	0.011
197	C₆₀H₃₆	0.012
198	C₆₀H₃₆	0.070
199	C₆₀H₃₆	0.039
200	C₆₀H₃₆	0.043

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