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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 TS1B	von Wolff, Niklas	Orca; 4.2.1; RELEASE	Single point	RKS	def2-TZVPP; def2-tzvpp/c	-1405.31719006; Eh
	11-Sep-2020	/Orca TS1CbpyEXP	von Wolff, Niklas	Orca; 4.2.1; RELEASE	Single point	RKS	def2-TZVPP; def2-tzvpp/c	-2012.18553934; Eh
	11-Sep-2020	/Orca TS1CEXP	von Wolff, Niklas	Orca; 4.2.1; RELEASE	Single point	RKS	def2-TZVPP; def2-tzvpp/c	-2016.97741780; Eh
	11-Sep-2020	/Orca TS2D	von Wolff, Niklas	Orca; 4.2.1; RELEASE	Single point	RKS	def2-TZVPP; def2-tzvpp/c	-1634.42634632; Eh
	11-Sep-2020	/Orca TS2E	von Wolff, Niklas	Orca; 4.2.1; RELEASE	Single point	RKS	def2-TZVPP; def2-tzvpp/c	-1634.43859317; Eh
	11-Sep-2020	/Orca TS3A	von Wolff, Niklas	Orca; 4.2.1; RELEASE	Single point	RKS	def2-TZVPP; def2-tzvpp/c	-1709.72422290; Eh
	11-Sep-2020	/Orca TS3Bbpy	von Wolff, Niklas	Orca; 4.2.1; RELEASE	Single point	RKS	def2-TZVPP; def2-tzvpp/c	-1704.90678540; Eh
	11-Sep-2020	/Orca TS3C	von Wolff, Niklas	Orca; 4.2.1; RELEASE	Single point	RKS	def2-TZVPP; def2-tzvpp/c	-1709.71959636; Eh
	11-Sep-2020	/Orca TS4Bbpy	von Wolff, Niklas	Orca; 4.2.1; RELEASE	Single point	RKS	def2-TZVPP; def2-tzvpp/c	-1704.93172787; Eh
	11-Sep-2020	/Orca TS4D	von Wolff, Niklas	Orca; 4.2.1; RELEASE	Single point	RKS	def2-TZVPP; def2-tzvpp/c	-1709.70208887; Eh

Results 101-110 of 636 (Search time: 0.001 seconds).