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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	11-Feb-2025	/C-O-H-Cu-cluster/225-Wullf/facet1 CO	Xuning, Wang	vasp; 5.4.1; 05Feb16 (build Aug 31 2021 10:13:08) gamma-only	Geometry optimization	DFT	-	-667.39281894; eV
	11-Feb-2025	/C-O-H-Cu-cluster/165-Wullf/facet1 CO	Xuning, Wang	vasp; 5.4.1; 05Feb16 (build Aug 31 2021 10:13:08) gamma-only	Geometry optimization	DFT	-	-483.26560171; eV
	11-Feb-2025	/C-O-H-Cu-cluster/309-D5h/corner1 CO	Xuning, Wang	vasp; 5.4.1; 05Feb16 (build Aug 31 2021 10:13:08) gamma-only	Geometry optimization	DFT	-	-921.07419971; eV
	11-Feb-2025	/C-O-H-Cu-cluster/85-Wullf/edge1 CHO	Xuning, Wang	vasp; 5.4.1; 05Feb16 (build Aug 31 2021 10:13:08) gamma-only	Geometry optimization	DFT	-	-251.26696247; eV
	11-Feb-2025	/C-O-H-Cu-cluster/55-D5h/edge3 CHOH	Xuning, Wang	vasp; 5.4.1; 24Jun15 (build Nov 12 2022 00:32:46) complex	Geometry optimization	DFT	-	-168.28701569; eV
	11-Feb-2025	/C-O-H-Cu-cluster/140-Wullf/corner CO	Xuning, Wang	vasp; 5.4.1; 24Jun15 (build Nov 12 2022 00:32:46) complex	Single point	DFT	-	-412.68320065; eV
	11-Feb-2025	/bare-Cu-cluster/rpso 110	Xuning, Wang	vasp; 5.4.1; 24Jun15 (build Nov 12 2022 00:42:08) gamma-only	Geometry optimization	DFT	-	-306.09542534; eV
	28-Feb-2025	zn_l2	Zlatar, Matija	AMS; 2024.101; r121099	Frequencies	BP86	-	-240.263586; eV
	28-Feb-2025	l	Zlatar, Matija	AMS; 2024.101; r121099	Frequencies	BP86	-	-121.902331; eV
	28-Feb-2025	hl	Zlatar, Matija	AMS; 2024.101; r121099	Frequencies	BP86	-	-121.976069; eV

Results 370541-370550 of 370568 (Search time: 0.391 seconds).