Zahra Homayoon

Direct Chemical Dynamics Simulations

Subha Pratihar, Xinyou Ma, Zahra Homayoon et al. · Journal of the American Chemical Society · 2017 · 149 citations

Molecular Kinetics, Chemical Kinetics, Engineering +12

Quasiclassical Trajectory Study of CH₃NO₂ Decomposition via Roaming Mediated Isomerization Using a Global Potential Energy Surface

Zahra Homayoon, Joel M. Bowman · The Journal of Physical Chemistry A · 2013 · 62 citations

Engineering, Roaming Mediated Isomerization, Physics +15

Photodissociation dynamics of nitromethane and methyl nitrite by infrared multiphoton dissociation imaging with quasiclassical trajectory calculations: Signatures of the roaming pathway

Ravin Fernando, Chamara Abeysekera, Zahra Homayoon et al. · The Journal of Chemical Physics · 2014 · 56 citations

Engineering, Irmpd Images, Chemistry +19

Full-dimensional, high-level <i>ab initio</i> potential energy surfaces for H2(H2O) and H2(H2O)2 with application to hydrogen clathrate hydrates

Zahra Homayoon, Riccardo Conte, Chen Qu et al. · The Journal of Chemical Physics · 2015 · 49 citations · Full text

Chemical Engineering, Engineering, Full Pess +15

Model Simulations of the Thermal Dissociation of the TIK(H⁺)₂ Tripeptide: Mechanisms and Kinetic Parameters

Zahra Homayoon, Subha Pratihar, Edward A. Dratz et al. · The Journal of Physical Chemistry A · 2016 · 41 citations