ASE database

Displaying rows 51-75 out of 594

↓ ID ✕	Formula ✕	Energy ✕	Volume ✕	PBC ✕	Maximum force ✕	perms_num ✕
51	C₆₀H₁₈	-599.277	4754.604	TTT	0.799	2
52	C₆₀H₁₈	-593.875	4371.561	TTT	1.598	1
53	C₆₀H₁₈	-594.901	8000.000	TTT	0.009	2
54	C₆₀H₁₈	-596.226	8000.000	TTT	0.010	2
55	C₆₀H₁₈	-594.245	8000.000	TTT	0.009	2
56	C₆₀H₁₈	-598.133	7542.702	TTT	0.201	2
57	C₆₀H₁₈	-597.545	5131.390	TTT	1.119	1
58	C₆₀H₁₈	-597.446	8000.000	TTT	0.009	2
59	C₆₀H₁₈	-587.564	7771.967	TTT	0.072	1
60	C₆₀H₁₈	-587.725	6701.678	TTT	0.637	2
61	C₆₀H₁₈	-586.594	7634.580	TTT	0.138	1
62	C₆₀H₁₈	-586.037	7667.294	TTT	0.063	2
63	C₆₀H₁₈	-590.220	7682.687	TTT	0.069	1
64	C₆₀H₁₈	-590.856	7721.960	TTT	0.076	2
65	C₆₀H₁₈	-584.527	7679.189	TTT	0.072	2
66	C₆₀H₁₈	-584.982	7821.192	TTT	0.042	1
67	C₆₀H₁₈	-586.998	7625.606	TTT	0.047	1
68	C₆₀H₁₈	-587.045	7729.419	TTT	0.026	2
69	C₆₀H₁₈	-587.321	7492.515	TTT	0.182	1
70	C₆₀H₁₈	-587.558	7771.328	TTT	0.075	2
71	C₆₀H₁₈	-585.752	7584.493	TTT	0.110	2
72	C₆₀H₁₈	-585.420	6626.567	TTT	0.709	1
73	C₆₀H₁₈	-596.070	7562.596	TTT	0.143	2
74	C₆₀H₁₈	-596.265	6506.858	TTT	0.441	1
75	C₆₀H₁₈	-595.494	8000.000	TTT	0.009	1

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