Ab initio static and molecular dynamics study of 4-styrylpyridine: Structure, energy and reactivity of the cis and trans isomers in the ground state
L.M. Lawson Daku, J. Linares and M.-L. Boillot ChemPhysChem, 8 (9) (2007), p1402-1416 Keywords: ab initio calculations; density functional calculations; isomerization; molecular dynamics; transition states
DOI:10.1002/cphc.200700117 | unige:3195 | Abstract | Article HTML | Article PDF
Ruthenium(II) as a Novel "Labile" Partner in Thermodynamic Self-Assembly of Heterobimetallic d-f Triple-Stranded Helicates
S. Torelli, S. Delahaye, A. Hauser, G. Bernardinelli and C. Piguet Chemistry - A European Journal, 10 (14) (2004), p3503-3516 Keywords: helical structures; isomerization; lanthanides; ruthenium; self-assembly
DOI:10.1002/chem.200400092 | unige:3258 | Abstract | Article HTML | Article PDF