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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	24-Feb-2019	Monoterpenes-12-G4	Pahima, Efrat	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RB3LYP; RCCSD; RMP4SDTQ; RMP2-Full; RHF; G4	-	-388.1274524; Eh
	24-Feb-2019	Monoterpenes-04-G4	Pahima, Efrat	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RB3LYP; RCCSD; RMP4SDTQ; RMP2-Full; RHF; G4	-	-388.1350515; Eh
	24-Feb-2019	Monoterpenes-02-G4	Pahima, Efrat	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RB3LYP; RCCSD; RMP4SDTQ; RMP2-Full; RHF; G4	-	-388.1317652; Eh
	15-Oct-2021	/GeomOpt_PBEPBE styrene	Occhipinti, Giovanni; Foscato, Marco; Jensen, Vidar R.	Gaussian; 16; ES64L-G16RevB.01	Geometry optimization Minimum	RHF; RPBEPBE	GEN	-309.2508804; Eh
	15-Oct-2021	/GeomOpt_PBEPBE trans-stilbene	Occhipinti, Giovanni; Foscato, Marco; Jensen, Vidar R.	Gaussian; 16; ES64L-G16RevB.01	Geometry optimization Minimum	RHF; RPBEPBE	GEN	-540.0389884; Eh
	15-Oct-2021	/GeomOpt_PBEPBE M1	Occhipinti, Giovanni; Foscato, Marco; Jensen, Vidar R.	Gaussian; 16; ES64L-G16RevB.01	Geometry optimization Minimum	RHF; RPBEPBE	GEN	-924.2147475; Eh
	15-Oct-2021	/GeomOpt_PBEPBE M2	Occhipinti, Giovanni; Foscato, Marco; Jensen, Vidar R.	Gaussian; 16; ES64L-G16RevB.01	Geometry optimization Minimum	RHF; RPBEPBE	GEN	-947.388422; Eh
	15-Oct-2021	/GeomOpt_PBEPBE M3	Occhipinti, Giovanni; Foscato, Marco; Jensen, Vidar R.	Gaussian; 16; ES64L-G16RevB.01	Geometry optimization Minimum	RHF; RPBEPBE	GEN	-755.882724; Eh
	15-Oct-2021	/GeomOpt_PBEPBE M5	Occhipinti, Giovanni; Foscato, Marco; Jensen, Vidar R.	Gaussian; 16; ES64L-G16RevB.01	Geometry optimization Minimum	RHF; RPBEPBE	GENECP GEN	-2628.7250562; Eh
	15-Oct-2021	/GeomOpt_PBEPBE M4	Occhipinti, Giovanni; Foscato, Marco; Jensen, Vidar R.	Gaussian; 16; ES64L-G16RevB.01	Geometry optimization Minimum	RHF; RPBEPBE	GENECP GEN	-2606.3407086; Eh

Results 61-70 of 298 (Search time: 0.002 seconds).