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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	5-Aug-2021	8cum_11me	Bro-Jørgensen, William	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RPBEPBE	6-311G(D,P)	-423.316809905; Eh
	5-Aug-2021	tzd_8cum_me	Bro-Jørgensen, William	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RPBEPBE	6-311++G	-423.226135332; Eh
	16-Jun-2021	metallacumulene	Bro-Jørgensen, William	Gaussian; 16; ES64L-G16RevA.03	Single point Minimum	RPBEPBE	CC-PVTZ SDD GEN	-2198.02552864; Eh
	16-Jun-2021	allene_linked8	Bro-Jørgensen, William	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RPBEPBE	6-311G(D,P)	-311.655565865; Eh
	5-Aug-2021	tz_8cum_me	Bro-Jørgensen, William	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RPBEPBE	6-311G	-423.222718883; Eh
	16-Jun-2021	mol_168	Bro-Jørgensen, William	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RPBEPBE	6-311G(D,P)	-309.1875395; Eh
	16-Jun-2021	mol_96	Bro-Jørgensen, William	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RPBEPBE	6-311G(D,P)	-309.1393896; Eh
	16-Jun-2021	dph_diyne_45	Bro-Jørgensen, William	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	-	6-311G(D,P)	-614.969139711; Eh
	6-Aug-2021	metallacumulene_wb97xd	Bro-Jørgensen, William	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RwB97XD	CC-PVTZ SDD GEN	-2199.30438693; Eh
	6-Aug-2021	metallacumulene_hf	Bro-Jørgensen, William	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RHF	CC-PVTZ SDD GEN	-2191.23280590; Eh

Results 21-30 of 195 (Search time: 0.002 seconds).