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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	11-Sep-2020	/Orca 8EXP	von Wolff, Niklas	Orca; 4.2.1; RELEASE	Single point	RKS	def2-TZVPP; def2-tzvpp/c	-2015.83861163; Eh
	11-Sep-2020	/Orca 10	von Wolff, Niklas	Orca; 4.2.1; RELEASE	Single point	RKS	def2-TZVPP; def2-tzvpp/c	-1708.59633789; Eh
	11-Sep-2020	/Orca H2O	von Wolff, Niklas	Orca; 4.2.1; RELEASE	Single point	RKS	def2-TZVPP; def2-tzvpp/c	-76.44014128; Eh
	11-Sep-2020	/Orca TS2F	von Wolff, Niklas	Orca; 4.2.1; RELEASE	Single point	RKS	def2-TZVPP; def2-tzvpp/c	-1634.43079177; Eh
	11-Sep-2020	/Orca TS5C	von Wolff, Niklas	Orca; 4.2.1; RELEASE	Single point	RKS	def2-TZVPP; def2-tzvpp/c	-1481.75956315; Eh
	11-Sep-2020	/Orca 6EXP	von Wolff, Niklas	Orca; 4.2.1; RELEASE	Single point	RKS	def2-TZVPP; def2-tzvpp/c	-2241.34824125; Eh
	11-Sep-2020	/Orca 7	von Wolff, Niklas	Orca; 4.2.1; RELEASE	Single point	RKS	def2-TZVPP; def2-tzvpp/c	-1703.80958505; Eh
	11-Sep-2020	/Orca 15EXP	von Wolff, Niklas	Orca; 4.2.1; RELEASE	Single point	RKS	def2-TZVPP; def2-tzvpp/c	-2011.05926437; Eh
	11-Sep-2020	/Orca 16	von Wolff, Niklas	Orca; 4.2.1; RELEASE	Single point	RKS	def2-TZVPP; def2-tzvpp/c	-1704.94454603; Eh
	11-Sep-2020	/Orca TS2Fbpy	von Wolff, Niklas	Orca; 4.2.1; RELEASE	Single point	RKS	def2-TZVPP; def2-tzvpp/c	-1629.64649967; Eh

Results 21-30 of 312 (Search time: 0.002 seconds).