Joshua D. Coe

Optimizing Conical Intersections without Derivative Coupling Vectors:  Application to Multistate Multireference Second-Order Perturbation Theory (MS-CASPT2)

Benjamin G. Levine, Joshua D. Coe, Todd J. Martı́nez · The Journal of Physical Chemistry B · 2007 · 417 citations

Numerical Analysis, Sequential Penalty, Engineering +22

Implementation of ab initio multiple spawning in the Molpro quantum chemistry package

Benjamin G. Levine, Joshua D. Coe, Aaron M. Virshup et al. · Chemical Physics · 2008 · 215 citations

Quantum Science, Engineering, Quantum Computing +8

Competitive Decay at Two- and Three-State Conical Intersections in Excited-State Intramolecular Proton Transfer

Joshua D. Coe, Todd J. Martı́nez · Journal of the American Chemical Society · 2005 · 128 citations

Ab Initio Molecular Dynamics of Excited-State Intramolecular Proton Transfer Using Multireference Perturbation Theory

Joshua D. Coe, Benjamin G. Levine, Todd J. Martı́nez · The Journal of Physical Chemistry A · 2007 · 122 citations

Ab Initio Molecular Dynamics of Excited-State Intramolecular Proton Transfer around a Three-State Conical Intersection in Malonaldehyde

Joshua D. Coe, Todd J. Martı́nez · The Journal of Physical Chemistry A · 2005 · 94 citations