Publications by authors named "JC Tully"

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Two-state model of energy dissipation at metal surfaces.
John C Tully

J Chem Phys· March 2024

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Correction to "Excited State Intramolecular Proton Transfer with Nuclear-Electronic Orbital Ehrenfest Dynamics".
Luning Zhao, Andrew Wildman, Fabijan Pavošević, John C Tully, Sharon Hammes-Schiffer

J Phys Chem Lett· May 2021

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Excited State Intramolecular Proton Transfer with Nuclear-Electronic Orbital Ehrenfest Dynamics.
Luning Zhao, Andrew Wildman, Fabijan Pavošević, John C Tully, Sharon Hammes-Schiffer

J Phys Chem Lett· April 2021

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Erratum: Role of Tensorial Electronic Friction in Energy Transfer at Metal Surfaces [Phys. Rev. Lett. 116, 217601 (2016)].
Mikhail Askerka, Reinhard J Maurer, Victor S Batista, John C Tully

Phys Rev Lett· August 2017

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Probing the remarkable thermal kinetics of visual rhodopsin with E181Q and S186A mutants.
Ying Guo, Heidi P Hendrickson, Pablo E Videla, Ya-Na Chen, Junming Ho, John C Tully

J Chem Phys· June 2017

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Mode Specific Electronic Friction in Dissociative Chemisorption on Metal Surfaces: H_{2} on Ag(111).
Reinhard J Maurer, Bin Jiang, Hua Guo, John C Tully

Phys Rev Lett· June 2017

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Role of Tensorial Electronic Friction in Energy Transfer at Metal Surfaces.
Mikhail Askerka, Reinhard J Maurer, Victor S Batista, John C Tully

Phys Rev Lett· May 2016

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Communication: Charge-population based dispersion interactions for molecules and materials.
Martin Stöhr, Georg S Michelitsch, John C Tully, Karsten Reuter, Reinhard J Maurer

J Chem Phys· April 2016

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Unusual kinetics of thermal decay of dim-light photoreceptors in vertebrate vision.
Ying Guo, Sivakumar Sekharan, Jian Liu, Victor S Batista, John C Tully

Proc Natl Acad Sci U S A· July 2014

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Orthogonality constrained density functional theory for electronic excited states.
Francesco A Evangelista, Philip Shushkov, John C Tully

J Phys Chem A· August 2013

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Nonadiabatic dynamics at metal surfaces: independent electron surface hopping with phonon and electron thermostats.
Neil Shenvi, John C Tully

Faraday Discuss· June 2013

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Perspective: Nonadiabatic dynamics theory.
John C Tully

J Chem Phys· December 2012

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Ring polymer molecular dynamics with surface hopping.
Philip Shushkov, Richard Li, John C Tully

J Chem Phys· December 2012

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Multiquantum vibrational excitation of NO scattered from Au(111): quantitative comparison of benchmark data to ab initio theories of nonadiabatic molecule-surface interactions.
Russell Cooper, Christof Bartels, Alexander Kandratsenka, Igor Rahinov, Neil Shenvi, John C Tully

Angew Chem Int Ed Engl· May 2012

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Vibrational Fano resonances in dipole-bound anions.
Stephen T Edwards, Mark A Johnson, John C Tully

J Chem Phys· April 2012

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Nonequilibrium Fermi golden rule for electronic transitions through conical intersections.
Artur F Izmaylov, David Mendive-Tapia, Michael J Bearpark, Michael A Robb, John C Tully

J Chem Phys· December 2011

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A tiered approach to Monte Carlo sampling with self-consistent field potentials.
Ryan P Steele, John C Tully

J Chem Phys· November 2011

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Mixed time slicing in path integral simulations.
Ryan P Steele, Jill Zwickl, Philip Shushkov, John C Tully

J Chem Phys· February 2011

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The driving mechanism behind attrition-enhanced deracemization.
Wim L Noorduin, Willem J P van Enckevort, Hugo Meekes, Bernard Kaptein, Richard M Kellogg, John C Tully

Angew Chem Int Ed Engl· November 2010

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Ab initio molecular dynamics with dual basis set methods.
Ryan P Steele, Martin Head-Gordon, John C Tully

J Phys Chem A· November 2010

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Photochemistry of DNA fragments via semiclassical nonadiabatic dynamics.
Anastassia N Alexandrova, John C Tully, Giovanni Granucci

J Phys Chem B· September 2010

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Relativistic interactions in the radical pair model of magnetic field sense in CRY-1 protein of Arabidopsis thaliana.
Artur F Izmaylov, John C Tully, Michael J Frisch

J Phys Chem A· November 2009

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Dynamical steering and electronic excitation in NO scattering from a gold surface.
Neil Shenvi, Sharani Roy, John C Tully

Science· November 2009

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Nonadiabatic dynamics at metal surfaces: independent-electron surface hopping.
Neil Shenvi, Sharani Roy, John C Tully

J Chem Phys· May 2009

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Model Hamiltonian for the interaction of NO with the Au(111) surface.
Sharani Roy, Neil A Shenvi, John C Tully

J Chem Phys· May 2009

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