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

Search

previous
1
...
597
598
599
600
601
602
603
...
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 shhgi2	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-575.381562513; Eh
	9-Nov-2018	/vacuum/complexes scuch3_2	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-635.422711119; Eh
	9-Nov-2018	/vacuum/complexes shagnhc	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-772.071438587; Eh
	9-Nov-2018	/vacuum/complexes shcuch3_2	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-636.158033416; Eh
	9-Nov-2018	/vacuum/complexes shyh2o5	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-818.924791230; Eh
	9-Nov-2018	/vacuum/complexes shzrome3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-791.486578376; Eh
	9-Nov-2018	/vacuum/complexes shfecl3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	UB3LYP	6-31+g; sdd*	-1903.60242096; Eh
	9-Nov-2018	/vacuum/complexes shaucn	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-627.570528761; Eh
	9-Nov-2018	/vacuum/complexes sfecl3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	UB3LYP	6-31+g; sdd*	-1902.95111670; Eh
	9-Nov-2018	/vacuum/complexes shgi2	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-574.712959448; Eh

Results 5991-6000 of 12842 (Search time: 0.005 seconds).