The dynamic behavior of a liquid ethanol–water mixture: a perspective from quantum chemical topology

Beyond the bond

(2010) Philip Ball   NATURE

Heteropentámeros (etanol)4-agua: estudio estructural y termodinámico

(2010) Sol M. Mejía et al.   QUIMICA NOVA

When Do Interacting Atoms Form a Chemical Bond? Spectroscopic Measurements and Theoretical Analyses of Dideuteriophenanthrene

(2009) Stefan Grimme et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Cooperative effects on the structure and stability of (ethanol)3–water, (methanol)3–water heterotetramers and (ethanol)4, (methanol)4 tetramers

(2009) Sol M. Mejía et al.   JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM

An Investigation of KS-DFT Electron Densities used in Atoms-in-Molecules Studies of Energetic Molecules

(2009) Anthony D. Yau et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Structure and Stability of Water Chains (H2O)n,n= 5−20†

(2009) R. Parthasarathi et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Bond Paths Are Not Chemical Bonds

(2009) Richard F. W. Bader   JOURNAL OF PHYSICAL CHEMISTRY A

Hydrogen-bond network and local structure of liquid water: An atoms-in-molecules perspective

(2008) Haigang Lu et al.   JOURNAL OF CHEMICAL PHYSICS

Properties and 3D Structure of Liquid Water:  A Perspective from a High-Rank Multipolar Electrostatic Potential

(2008) Steven Y. Liem et al.   Journal of Chemical Theory and Computation

The importance of multipole moments when describing water and hydrated amino acid cluster geometry

(2008) Majeed Shaik et al.   MOLECULAR PHYSICS

DL_MULTI—A molecular dynamics program to use distributed multipole electrostatic models to simulate the dynamics of organic crystals

(2008) M. Leslie   MOLECULAR PHYSICS

Raman spectroscopic evidence for the most stable water/ethanol dimer and for the negative mixing energy in cold water/ethanol trimers

(2008) Marija Nedić et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Interfacial properties of water+alcohol mixtures

(2007) Sabine Enders et al.   FLUID PHASE EQUILIBRIA