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

Search

previous
1
...
3202
3203
3204
3205
3206
3207
3208
...
10408
next

Item hits:

Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	28-Nov-2017	ss-CuAg-0000	García Muelas, Rodrigo	vasp; 5.3.5; 31Mar14 (build Jun 1 2014 07:54:15) complex	Geometry optimization	-	-	-151.61795960; eV
	28-Nov-2017	ss-NiPt-0000	García Muelas, Rodrigo	vasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complex	Geometry optimization	-	-	-251.37339125; eV
	19-Mar-2026	/VW V01W09O34-3H-iso-0	Buils, Jordi	ADF; 2019	Geometry optimization	PBE	TZP	-14.97534556; Eh
	28-Nov-2017	ol-RhCo-2215	García Muelas, Rodrigo	vasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complex	Geometry optimization	-	-	-360.87508630; eV
	28-Nov-2017	ol-RhPt-2215	García Muelas, Rodrigo	vasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complex	Geometry optimization	-	-	-356.17319710; eV
	28-Nov-2017	ol-RhNi-2215	García Muelas, Rodrigo	vasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complex	Geometry optimization	-	-	-343.04464152; eV
	28-Nov-2017	ol-RhOs-2215	García Muelas, Rodrigo	vasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complex	Geometry optimization	-	-	-410.06982650; eV
	28-Nov-2017	ol-RhPd-0111	García Muelas, Rodrigo	vasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complex	Geometry optimization	-	-	-322.25396388; eV
	28-Nov-2017	ol-RhFe-0111	García Muelas, Rodrigo	vasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complex	Geometry optimization	-	-	-354.76619225; eV
	28-Nov-2017	ol-RhPt-0000	García Muelas, Rodrigo	vasp; 5.3.5; 31Mar14 (build Jun 1 2014 07:54:15) complex	Geometry optimization	-	-	-324.31973480; eV

Results 32041-32050 of 104079 (Search time: 0.02 seconds).