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

Search

previous
1
...
1473
1474
1475
1476
1477
1478
1479
...
10459
next

Item hits:

Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	9-Nov-2018	/noDisp/complexes sin-tiofenohgi2_newfix2freq	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-729.4700166; Eh
	9-Nov-2018	/noDisp/complexes sin-sincl2	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-1320.7106838; Eh
	9-Nov-2018	/noDisp/complexes sin-tiofenozrome3_newfix	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-945.4346599; Eh
	9-Nov-2018	/noDisp/complexes sin-xegacl3_newfix	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-1398.3421049; Eh
	9-Nov-2018	/noDisp/complexes sin-bpinmno3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-583.9700787; Eh
	9-Nov-2018	/noDisp/complexes sin-sime3rhh2o5	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-901.4639735; Eh
	9-Nov-2018	/noDisp/complexes sin-sime3ZrCl5	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-2757.71679; Eh
	9-Nov-2018	/noDisp/complexes sin-sime3rush4	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-2099.5352754; Eh
	9-Nov-2018	/noDisp/complexes sin-sime3ticl3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-1848.3943005; Eh
	9-Nov-2018	/noDisp/complexes sin-smeaucl3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-1954.654583; Eh

Results 14751-14760 of 104583 (Search time: 0.011 seconds).