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Item hits:

Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	7-Jun-2023	bensulide_CONF402_gas	Pulgar Rubio, Antonio	Orca; 5.0.2; RELEASE	Single point	-	def2-TZVPP	-2439.75681505; Eh
	22-Sep-2023	Carbosulfan_CONF105_gas	Pulgar Rubio, Antonio	Orca; 5.0.2; RELEASE	Single point	-	def2-TZVPP	-1514.89961964; Eh
	22-Sep-2023	Carbosulfan_CONF1077_gas	Pulgar Rubio, Antonio	Orca; 5.0.2; RELEASE	Single point	-	def2-TZVPP	-1514.89679630; Eh
	22-Sep-2023	Carbosulfan_CONF1024_gas	Pulgar Rubio, Antonio	Orca; 5.0.2; RELEASE	Single point	-	def2-TZVPP	-1514.90101918; Eh
	22-Sep-2023	Carbosulfan_CONF1020_gas	Pulgar Rubio, Antonio	Orca; 5.0.2; RELEASE	Single point	-	def2-TZVPP	-1514.90050421; Eh
	31-Mar-2024	(Toluene)K(NTMS2)2ZnCH2Ph-1e	Mulks, Florian	Orca; 5.0.4; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-4662.16384758; Eh
	31-Mar-2024	(Toluene)K(NTMS2)2ZnCH2Ph	Mulks, Florian	Orca; 5.0.4; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-4662.38245724; Eh
	22-Sep-2023	Phorate_CONF788_water	Pulgar Rubio, Antonio	Orca; 5.0.3; RELEASE	Single point	-	def2-TZVPP	-1963.55459887; Eh
	31-Mar-2024	(Toluene)K(NTMS2)2ZnCH2Ph-2e	Mulks, Florian	Orca; 5.0.4; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-4661.75036459; Eh
	22-Sep-2023	Phorate_CONF76_water	Pulgar Rubio, Antonio	Orca; 5.0.3; RELEASE	Single point	-	def2-TZVPP	-1963.55051914; Eh

Results 84661-84670 of 84874 (Search time: 0.079 seconds).