ioChem-BD Browse - Institute of Chemical Research of Catalonia: Search

Search

previous
1
...
668
669
670
671
672
673
674
...
1285
next

Item hits:

Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	9-Nov-2018	/vacuum/complexes fagnhc	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-473.116509448; Eh
	9-Nov-2018	/vacuum/complexes cozrome3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-505.741033938; Eh
	9-Nov-2018	/vacuum/complexes cnfecl3-	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	UB3LYP	6-31+g; sdd*	-1597.61708669; Eh
	9-Nov-2018	/vacuum/complexes clptph3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point TS	RB3LYP	6-31+g; sdd*	-922.879357738; Eh
	9-Nov-2018	/vacuum/complexes coaucl3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point TS	RB3LYP	6-31+g; sdd*	-1629.72668463; Eh
	9-Nov-2018	/vacuum/complexes bpinaucl3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-1770.58069398; Eh
	9-Nov-2018	/vacuum/complexes bpinaucn	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-482.759284321; Eh
	9-Nov-2018	/vacuum/complexes conipf33	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-2207.34348265; Eh
	9-Nov-2018	/vacuum/complexes cofecl3-	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	UB3LYP	6-31+g; sdd*	-1618.12815106; Eh
	9-Nov-2018	/vacuum/complexes cnincl2	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-1015.23390943; Eh

Results 6701-6710 of 12842 (Search time: 0.006 seconds).