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Item hits:

Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	22-Sep-2023	Phorate_CONF116_water	Pulgar Rubio, Antonio	Orca; 5.0.3; RELEASE	Single point	-	def2-TZVPP	-1963.54929305; Eh
	22-Sep-2023	Phorate_CONF809_octanol	Pulgar Rubio, Antonio	Orca; 5.0.3; RELEASE	Single point	-	def2-TZVPP	-1963.56063839; Eh
	22-Sep-2023	Phorate_CONF803_octanol	Pulgar Rubio, Antonio	Orca; 5.0.3; RELEASE	Single point	-	def2-TZVPP	-1963.56369627; Eh
	22-Sep-2023	Phorate_CONF802_octanol	Pulgar Rubio, Antonio	Orca; 5.0.3; RELEASE	Single point	-	def2-TZVPP	-1963.56385595; Eh
	22-Sep-2023	Phorate_CONF798_octanol	Pulgar Rubio, Antonio	Orca; 5.0.3; RELEASE	Single point	-	def2-TZVPP	-1963.56371521; Eh
	22-Sep-2023	Phorate_CONF82_octanol	Pulgar Rubio, Antonio	Orca; 5.0.3; RELEASE	Single point	-	def2-TZVPP	-1963.56266433; Eh
	22-Sep-2023	Phorate_CONF81_octanol	Pulgar Rubio, Antonio	Orca; 5.0.3; RELEASE	Single point	-	def2-TZVPP	-1963.56230773; Eh
	22-Sep-2023	Phorate_CONF797_octanol	Pulgar Rubio, Antonio	Orca; 5.0.3; RELEASE	Single point	-	def2-TZVPP	-1963.56353974; Eh
	22-Sep-2023	Phorate_CONF796_octanol	Pulgar Rubio, Antonio	Orca; 5.0.3; RELEASE	Single point	-	def2-TZVPP	-1963.56542397; Eh
	22-Sep-2023	Phorate_CONF8_octanol	Pulgar Rubio, Antonio	Orca; 5.0.3; RELEASE	Single point	-	def2-TZVPP	-1963.55983483; Eh

Results 84711-84720 of 84874 (Search time: 0.073 seconds).