Alessandro Curioni, Michiel Sprik, et al.
JACS
We classify the equilibrium structures of sp-bonded tetramers with schemes based on valence electron orbital radii. Valence electron orbital radii plots show the transition from planar to nonplanar geometries, and account for trends in bond angles, thus confirming the success previously obtained by Andreoni, Galli, and Tosi for AB2 molecules. © 1987 The American Physical Society.
Alessandro Curioni, Michiel Sprik, et al.
JACS
Tiziana Mordasini, Alessandro Curioni, et al.
Journal of Biological Chemistry
Salomon R. Billeter, Alessandro Curioni, et al.
Physical Review B - CMMP
Alessandro Curioni, Mauro Boero, et al.
Chemical Physics Letters