Farnaz A. Shakib

Disentangling Coupling Effects in the Infrared Spectra of Liquid Water

Kelly M. Hunter, Farnaz A. Shakib, Francesco Paesani · The Journal of Physical Chemistry B · 2018 · 70 citations

Ring Polymer Surface Hopping: Incorporating Nuclear Quantum Effects into Nonadiabatic Molecular Dynamics Simulations

Farnaz A. Shakib, Pengfei Huo · The Journal of Physical Chemistry Letters · 2017 · 68 citations

Engineering, Excitation Energy Transfer, Computational Chemistry +18

Carbenes with Reduced Heteroatom Stabilization: A Computational Approach

M.Z. Kassaee, Farnaz A. Shakib, Mohammad R. Momeni et al. · The Journal of Organic Chemistry · 2010 · 53 citations

Novel Organocatalysts, Triplet States, Engineering +12

A DFT study on pyridine-derived N-heterocyclic carbenes

M.Z. Kassaee, Farnaz A. Shakib, Mohammad R. Momeni et al. · Tetrahedron · 2009 · 37 citations

Heterocyclic, Organic Chemistry, Dft Study +2

Novel α-spirocyclic (alkyl)(amino)carbenes at the theoretical crossroad of flexibility and rigidity

M.Z. Kassaee, Mohammad R. Momeni, Farnaz A. Shakib et al. · Structural Chemistry · 2010 · 32 citations

Organic Material Chemistry, Engineering, Heterocyclic +5