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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	17-Nov-2021	/Clonidine_Clusters/H2O_Clusters Clonidine_H2O_3b	Haack, Alexander	Orca; 5.0.1; RELEASE	Geometry optimization	-	def2-TZVPP	-1662.87535135; Eh
	17-Nov-2021	/Clonidine_Clusters/MeOH_Clusters Clonidine_MeOH_2c	Haack, Alexander	Orca; 5.0.1; RELEASE	Geometry optimization	-	def2-TZVPP	-1665.02148334; Eh
	17-Nov-2021	/Clonidine_Clusters/MeOH_Clusters Clonidine_MeOH_3r	Haack, Alexander	Orca; 5.0.1; RELEASE	Geometry optimization	-	def2-TZVPP	-1780.76239522; Eh
	17-Nov-2021	/Clonidine_Clusters/MeOH_Clusters Clonidine_MeOH_3o	Haack, Alexander	Orca; 5.0.1; RELEASE	Geometry optimization	-	def2-TZVPP	-1780.76438977; Eh
	17-Nov-2021	/Clonidine_Clusters/MeOH_Clusters Clonidine_MeOH_3m	Haack, Alexander	Orca; 5.0.1; RELEASE	Geometry optimization	-	def2-TZVPP	-1780.76806899; Eh
	10-Sep-2019	trans_NdO(OH)2(NO3)2	Bandeira, Nuno	Orca; 4.0.1.2; RELEASE	Geometry optimization	RI-MP2; mp2	AutoAux; SARC-ZORA-TZVPP; ZORA-def2-TZVP	-10593.78208090; Eh
	17-Nov-2021	/Clonidine_Clusters/MeOH_Clusters Clonidine_MeOH_3u	Haack, Alexander	Orca; 5.0.1; RELEASE	Geometry optimization	-	def2-TZVPP	-1780.76373077; Eh
	17-Nov-2021	/NicotinicAcid_Clusters/MeOH_Clusters NicotinicAcid_MeOH_3d	Haack, Alexander	Orca; 5.0.1; RELEASE	Geometry optimization	-	def2-TZVPP	-784.56033076; Eh
	17-Nov-2021	/NicotinicAcid_Clusters/MeOH_Clusters NicotinicAcid_MeOH_3f	Haack, Alexander	Orca; 5.0.1; RELEASE	Geometry optimization	-	def2-TZVPP	-784.55351402; Eh
	17-Nov-2021	/NicotinicAcid_Clusters/MeOH_Clusters NicotinicAcid_MeOH_3h	Haack, Alexander	Orca; 5.0.1; RELEASE	Geometry optimization	-	def2-TZVPP	-784.55343227; Eh

Results 31-40 of 328 (Search time: 0.002 seconds).