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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	17-Nov-2021	/bare_ions 4-Cyanobenzylamine	Haack, Alexander	Orca; 5.0.1; RELEASE	Geometry optimization Minimum	-	def2-TZVPP	-419.53626139; Eh
	17-Nov-2021	/3-Bromoquinoline_Clusters/MeOH_Clusters 3-Bromoquinoline_MeOH_4h	Haack, Alexander	Orca; 5.0.1; RELEASE	Geometry optimization Minimum	-	def2-TZVPP	-3438.96075564; Eh
	17-Nov-2021	/3-Bromoquinoline_Clusters/MeOH_Clusters 3-Bromoquinoline_MeOH_4e	Haack, Alexander	Orca; 5.0.1; RELEASE	Geometry optimization Minimum	-	def2-TZVPP	-3438.96701995; Eh
	17-Nov-2021	/3-Bromoquinoline_Clusters/MeOH_Clusters 3-Bromoquinoline_MeOH_4k	Haack, Alexander	Orca; 5.0.1; RELEASE	Geometry optimization Minimum	-	def2-TZVPP	-3438.95758936; Eh
	17-Nov-2021	/3-Bromoquinoline_Clusters/MeOH_Clusters 3-Bromoquinoline_MeOH_4d	Haack, Alexander	Orca; 5.0.1; RELEASE	Geometry optimization Minimum	-	def2-TZVPP	-3438.96946662; Eh
	17-Nov-2021	/3-Bromoquinoline_Clusters/MeOH_Clusters 3-Bromoquinoline_MeOH_3d	Haack, Alexander	Orca; 5.0.1; RELEASE	Geometry optimization Minimum	-	def2-TZVPP	-3323.21240309; Eh
	17-Nov-2021	/3-Bromoquinoline_Clusters/MeOH_Clusters 3-Bromoquinoline_MeOH_4b	Haack, Alexander	Orca; 5.0.1; RELEASE	Geometry optimization Minimum	-	def2-TZVPP	-3438.96885333; Eh
	17-Nov-2021	/3-Bromoquinoline_Clusters/MeOH_Clusters 3-Bromoquinoline_MeOH_2c	Haack, Alexander	Orca; 5.0.1; RELEASE	Geometry optimization Minimum	-	def2-TZVPP	-3207.45301756; Eh
	17-Nov-2021	/3-Bromoquinoline_Clusters/MeOH_Clusters 3-Bromoquinoline_MeOH_3b	Haack, Alexander	Orca; 5.0.1; RELEASE	Geometry optimization Minimum	-	def2-TZVPP	-3323.21443629; Eh
	17-Nov-2021	/3-Bromoquinoline_Clusters/MeOH_Clusters 3-Bromoquinoline_MeOH_3c	Haack, Alexander	Orca; 5.0.1; RELEASE	Geometry optimization Minimum	-	def2-TZVPP	-3323.21365170; Eh

Results 71-80 of 131 (Search time: 0.001 seconds).