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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	5-May-2021	/BenzylAlcohol_Alkene_Complex/DFT Benzylium_OH_Isopropylene_2	Ieritano, Christian	Orca; 4.2.1; RELEASE	Geometry optimization Minimum	-	def2-TZVPP	-463.85139776; Eh
	5-May-2021	/Carbocations/DLPNO-CCSDT Isopropylium	Ieritano, Christian	Orca; 4.2.1; RELEASE	Single point	DLPNO-CCSD(T)	def2-TZVPP; def2-TZVPP/C	-117.42879288; Eh
	5-May-2021	/Alkenes/DLPNO-CCSDT Isopropylene	Ieritano, Christian	Orca; 4.2.1; RELEASE	Single point	DLPNO-CCSD(T)	def2-TZVPP; def2-TZVPP/C	-117.12003951; Eh
	5-May-2021	/Proton_Transfer_Transition_States/DLPNO-CCSDT pOiPr_Ei_TS_CCSDT	Ieritano, Christian	Orca; 4.2.1; RELEASE	Single point	DLPNO-CCSD(T)	def2-TZVPP; def2-TZVPP/C	-460.98876329; Eh
	5-May-2021	/4-methylenecyclohexa-2,5-dien-1-one 4-methylenecyclohexa-2,5-dien-1-one_DLPNO-CCSDT	Ieritano, Christian	Orca; 4.2.1; RELEASE	Single point	DLPNO-CCSD(T)	def2-TZVPP; def2-TZVPP/C	-343.52851270; Eh
	5-May-2021	/Benzylpyridinium/DFT pOiPr_BP_1	Ieritano, Christian	Orca; 4.2.1; RELEASE	Geometry optimization Minimum	-	def2-TZVPP	-712.23851288; Eh
	5-May-2021	/Benzylium/DLPNO-CCSDT pOtBu_Benzylium_2	Ieritano, Christian	Orca; 4.2.1; RELEASE	Single point	DLPNO-CCSD(T)	def2-TZVPP; def2-TZVPP/C	-500.09023512; Eh
	5-May-2021	/BenzylAlcohol_Alkene_Complex/DLPNO-CCSDT Benzylium_OH_tert_butylene_5	Ieritano, Christian	Orca; 4.2.1; RELEASE	Single point	DLPNO-CCSD(T)	def2-TZVPP; def2-TZVPP/C	-500.07805081; Eh
	5-May-2021	/BenzylAlcohol_Alkene_Complex/DLPNO-CCSDT Benzylium_OH_Isopropylene_1	Ieritano, Christian	Orca; 4.2.1; RELEASE	Single point	DLPNO-CCSD(T)	def2-TZVPP; def2-TZVPP/C	-461.02455876; Eh
	5-May-2021	/BenzylAlcohol_Alkene_Complex/DFT Benzylium_OH_Ethylene_1	Ieritano, Christian	Orca; 4.2.1; RELEASE	Geometry optimization	-	def2-TZVPP	-424.52634638; Eh

Results 31-40 of 77 (Search time: 0.002 seconds).