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Browsing by Author Petter, Dunås

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Showing results 41 to 56 of 56 < previous

Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	23-Oct-2019	TS5_trans_in	Petter, Dunås	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	RB3LYP	GEN	-
	23-Oct-2019	TS5_trans_out	Petter, Dunås	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	RB3LYP	GEN	-
	23-Oct-2019	TS6_cis_in	Petter, Dunås	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	RB3LYP	GEN	-
	23-Oct-2019	TS6_cis_out	Petter, Dunås	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	RB3LYP	GEN	-
	23-Oct-2019	TS6_trans_in	Petter, Dunås	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	RB3LYP	GEN	-
	23-Oct-2019	TS6_trans_out	Petter, Dunås	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	RB3LYP	GEN	-
	23-Oct-2019	TS7_cis_in	Petter, Dunås	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	RB3LYP	GEN	-
	23-Oct-2019	TS7_cis_out	Petter, Dunås	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	RB3LYP	GEN	-
	23-Oct-2019	TS7_trans_in	Petter, Dunås	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	RB3LYP	GEN	-
	23-Oct-2019	TS7_trans_out	Petter, Dunås	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	RB3LYP	GEN	-
	23-Oct-2019	TS8_cis_in	Petter, Dunås	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	RB3LYP	GEN	-
	23-Oct-2019	TS8_cis_out	Petter, Dunås	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	RB3LYP	GEN	-
	23-Oct-2019	TS8_trans_in	Petter, Dunås	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	RB3LYP	GEN	-
	23-Oct-2019	TS8_trans_out	Petter, Dunås	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	RB3LYP	GEN	-
	23-Oct-2019	TS9	Petter, Dunås	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	RB3LYP	GEN	-
	23-Oct-2019	TS9_bidentate	Petter, Dunås	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	RB3LYP	GEN	-

Showing results 41 to 56 of 56 < previous