Two worlds collide: Image analysis methods for quantifying structural variation in cluster molecular dynamics

ChemNetworks: A complex network analysis tool for chemical systems

(2013) Abdullah Ozkanlar et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

First-principles melting of gallium clusters down to nine atoms: structural and electronic contributions to melting

(2013) Krista G. Steenbergen et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Geometrically induced melting variation in gallium clusters from first principles

(2013) K. G. Steenbergen et al.   PHYSICAL REVIEW B

Electronic effects on the melting of small gallium clusters

(2012) K. G. Steenbergen et al.   JOURNAL OF CHEMICAL PHYSICS

MoleculaRnetworks: An integrated graph theoretic and data mining tool to explore solvent organization in molecular simulation

(2012) Barbara Logan Mooney et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Novel Analysis of Cation Solvation Using a Graph Theoretic Approach

(2012) Barbara Logan Mooney et al.   JOURNAL OF PHYSICAL CHEMISTRY B

The discovery of unexpected isomers in sodium heptamers by Born–Oppenheimer molecular dynamics

(2009) José Manuel Vásquez-Pérez et al.   JOURNAL OF CHEMICAL PHYSICS