ASE database

Displaying rows 101-125 out of 414

↓ ID ✕	Formula ✕	PBC ✕	Energy ✕	Maximum stress ✕	Calculator ✕
101	C₆₀H₁₈	TTT	-597.097	0.001	vasp
102	C₆₀H₁₈	TTT	-590.967	0.000	vasp
103	C₆₀H₁₈	TTT	-595.597	0.001	vasp
104	C₆₀H₁₈	TTT	-592.900	0.001	vasp
105	C₆₀H₁₈	TTT	-589.547	0.000	vasp
106	C₆₀H₁₈	TTT	-589.673	0.001	vasp
107	C₆₀H₁₈	TTT	-592.796	0.000	vasp
108	C₆₀H₁₈	TTT	-590.711	0.002	vasp
109	C₆₀H₁₈	TTT	-592.437	0.000	vasp
110	C₆₀H₁₈	TTT	-592.253	0.000	vasp
111	C₆₀H₁₈	TTT	-592.325	0.000	vasp
112	C₆₀H₁₈	TTT	-593.631	0.000	vasp
113	C₆₀H₁₈	TTT	-593.119	0.000	vasp
114	C₆₀H₁₈	TTT	-595.165	0.000	vasp
115	C₆₀H₁₈	TTT	-587.053	0.000	vasp
116	C₆₀H₁₈	TTT	-593.900	0.000	vasp
117	C₆₀H₁₈	TTT	-594.583	0.001	vasp
118	C₆₀H₁₈	TTT	-598.422	0.000	vasp
119	C₆₀H₁₈	TTT	-595.745	0.006	vasp
120	C₆₀H₁₈	TTT	-587.543	0.062	vasp
121	C₆₀H₁₈	TTT	-592.692	0.000	vasp
122	C₆₀H₁₈	TTT	-597.235	0.000	vasp
123	C₆₀H₁₈	TTT	-583.021	0.094	vasp
124	C₆₀H₁₈	TTT	-592.369	0.000	vasp
125	C₆₀H₁₈	TTT	-594.254	0.000	vasp

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