Showing results (71-80 of 91) with videos related to
Sort By:
Pageof 10
Journal of Molecular Modeling|May 31, 2012
Halogen bond tunability II: the varying roles of electrostatic and dispersion contributions to attraction in halogen bondsKevin E Riley, Jane S Murray, Jindřich Fanfrlík, et al.The Journal of Chemical Physics|July 23, 2004
Calculation of electrostatic and polarization energies from electron densitiesYuguang Ma, Peter PolitzerThe Journal of Chemical Physics|July 23, 2004
Determination of noncovalent interaction energies from electronic densitiesYuguang Ma, Peter PolitzerPhysical Chemistry Chemical Physics : PCCP|October 20, 2025
The anomalous nature of fluorine revisited: amazing consequencesJane S MurrayMolecules (Basel, Switzerland)|February 10, 2024
The Formation of σ-Hole Bonds: A Physical InterpretationJane S MurrayThe Journal of Chemical Physics|March 18, 2006
Nonreactive molecular dynamics force field for crystalline hexahydro-1,3,5-trinitro-1,3,5 triazineSylke Boyd, Matthew Gravelle, Peter PolitzerJournal of Molecular Modeling|February 23, 2024
Anisotropies in electronic densities and electrostatic potentials of Halonium Ions: focus on Chlorine, Bromine and IodinePonnadurai Ramasami, Jane S MurrayThe Journal of Physical Chemistry. A|September 28, 2023
Intramolecular Repulsion Visible Through the Electrostatic Potential in Disulfides: Analysis via Varying Iso-density EnvelopesGoedele Roos, Jane S MurrayPhysical Chemistry Chemical Physics : PCCP|February 16, 2024
Probing intramolecular interactions using molecular electrostatic potentials: changing electron density contours to unveil both attractive and repulsive interactionsGoedele Roos, Jane S MurrayChemphyschem : a European Journal of Chemical Physics and Physical Chemistry|May 22, 2024
Radial Behavior of Electrostatic Potentials of Atoms and Ions Revisited: Isotropy and AnisotropyPonnadurai Ramasami, Jane S MurrayPageof 10