Alexander B. Pacheco

Experimental and Ab Initio Dynamical Investigations of the Kinetics and Intramolecular Energy Transfer Mechanisms for the OH + 1,3-Butadiene Reaction between 263 and 423 K at Low Pressure

D. Vimal, Alexander B. Pacheco, Srinivasan S. Iyengar et al. · The Journal of Physical Chemistry A · 2008 · 31 citations

Influence of Water on Anharmonicity, Stability, and Vibrational Energy Distribution of Hydrogen-Bonded Adducts in Atmospheric Reactions: Case Study of the OH + Isoprene Reaction Intermediate Using Ab Initio Molecular Dynamics

Scott M. Dietrick, Alexander B. Pacheco, Prasad Phatak et al. · The Journal of Physical Chemistry A · 2011 · 27 citations

Engineering, Organic Chemistry, Computational Chemistry +19

A multistage <i>ab initio</i> quantum wavepacket dynamics formalism for electronic structure and dynamics in open systems

Alexander B. Pacheco, Srinivasan S. Iyengar · The Journal of Chemical Physics · 2010 · 14 citations · Full text

Quantum Dynamic, Engineering, Many-body Quantum Physic +19

Introduction to Computational Chemistry

Alexander B. Pacheco · 2011 · 14 citations

Engineering, Natural Sciences, Molecular Computing +4

A Grotthuss-like proton shuttle in the anomalous C₂H₃⁺carbocation: energetic and vibrational properties for isotopologues

Junjie Li, Alexander B. Pacheco, Krishnan Raghavachari et al. · Physical Chemistry Chemical Physics · 2016 · 11 citations