Ravishankar Sundararaman

发表

Implicit Solvation for Electrochemical Interfaces

Kathleen A. Schwarz, Kendra Letchworth-Weaver, Ravishankar Sundararaman, 2017 .

JDFTx: Software for joint density-functional theory

Kathleen A. Schwarz, Ravishankar Sundararaman, Deniz Gunceler, 2017, SoftwareX.

Efficient classical density-functional theories of rigid-molecular fluids and a simplified free energy functional for liquid water

Ravishankar Sundararaman, T. A. Arias, T. Arias, 2013, Comput. Phys. Commun..

The importance of nonlinear fluid response in joint density-functional theory studies of battery systems

Kathleen A. Schwarz, Kendra Letchworth-Weaver, Ravishankar Sundararaman, 2013, 1301.6189.

A recipe for free-energy functionals of polarizable molecular fluids.

Kendra Letchworth-Weaver, Ravishankar Sundararaman, T A Arias, 2014, The Journal of chemical physics.

Mechanistic Explanation of the pH Dependence and Onset Potentials for Hydrocarbon Products from Electrochemical Reduction of CO on Cu (111).

Ravishankar Sundararaman, Tao Cheng, Hai Xiao, 2016, Journal of the American Chemical Society.

Theoretical predictions for hot-carrier generation from surface plasmon decay

Ravishankar Sundararaman, Harry A. Atwater, William A. Goddard III, 2014, Nature Communications.

Solvation effects on the band edge positions of photocatalysts from first principles.

Ravishankar Sundararaman, Yuan Ping, William A Goddard, 2015, Physical chemistry chemical physics : PCCP.

Regularization of the Coulomb singularity in exact exchange by Wigner-Seitz truncated interactions: Towards chemical accuracy in nontrivial systems

Ravishankar Sundararaman, T. A. Arias, T. Arias, 2013, 1302.6204.

Evaluating continuum solvation models for the electrode-electrolyte interface: Challenges and strategies for improvement.

Kathleen A. Schwarz, Ravishankar Sundararaman, R. Sundararaman, 2016, The Journal of chemical physics.

Plasmonic hot electron transport drives nano-localized chemistry

Ravishankar Sundararaman, Sebastian Schlücker, Stefan A Maier, 2017, Nature Communications.

A computationally efficacious free-energy functional for studies of inhomogeneous liquid water.

Kendra Letchworth-Weaver, Ravishankar Sundararaman, T A Arias, 2011, The Journal of chemical physics.

Far-from-equilibrium transport of excited carriers in nanostructures

William A. Goddard, Ravishankar Sundararaman, Harry A. Atwater, 2017, 1707.07060.

Nonradiative Plasmon Decay and Hot Carrier Dynamics: Effects of Phonons, Surfaces, and Geometry.

Ravishankar Sundararaman, Harry A Atwater, William A Goddard, 2016, ACS nano.

Formic acid oxidation on platinum: a simple mechanistic study.

Kathleen A. Schwarz, Ravishankar Sundararaman, Kathleen A Schwarz, 2015, Physical chemistry chemical physics : PCCP.

Implicit solvation model for density-functional study of nanocrystal surfaces and reaction pathways.

Kendra Letchworth-Weaver, Ravishankar Sundararaman, T A Arias, 2013, The Journal of chemical physics.

First-principles electrostatic potentials for reliable alignment at interfaces and defects.

Ravishankar Sundararaman, Yuan Ping, Y. Ping, 2016, The Journal of chemical physics.

The charge-asymmetric nonlocally determined local-electric (CANDLE) solvation model.

Ravishankar Sundararaman, William A Goddard, W. Goddard, 2014, The Journal of chemical physics.

Cubic Nonlinearity Driven Up-Conversion in High-Field Plasmonic Hot Carrier Systems

William A. Goddard, Ravishankar Sundararaman, Harry A. Atwater, 2016 .

Ab initio phonon coupling and optical response of hot electrons in plasmonic metals

William A. Goddard, Ravishankar Sundararaman, Harry A. Atwater, 2016, 1602.00625.

Grand canonical electronic density-functional theory: Algorithms and applications to electrochemistry.

Ravishankar Sundararaman, William A Goddard, T. Arias, 2017, The Journal of chemical physics.

Experimental and Ab Initio Ultrafast Carrier Dynamics in Plasmonic Nanoparticles.

Ravishankar Sundararaman, Harry A Atwater, William A Goddard, 2016, Physical review letters.

Partial oxidation of step-bound water leads to anomalous pH effects on metal electrode step-edges.

Kathleen A. Schwarz, Ravishankar Sundararaman, Bingjun Xu, 2016, Physical chemistry chemical physics : PCCP.

Weighted-density functionals for cavity formation and dispersion energies in continuum solvation models.

Ravishankar Sundararaman, T A Arias, Deniz Gunceler, 2014, The Journal of chemical physics.

Spicing up continuum solvation models with SaLSA: the spherically averaged liquid susceptibility ansatz.

Kathleen A. Schwarz, Kendra Letchworth-Weaver, Ravishankar Sundararaman, 2014, The Journal of chemical physics.

Electroless Formation of Hybrid Lithium Anodes for Fast Interfacial Ion Transport.

Ravishankar Sundararaman, Lynden A Archer, Snehashis Choudhury, 2017, Angewandte Chemie.

Nanoscale imaging of lithium ion distribution during in situ operation of battery electrode and electrolyte.

Jie Gao, Kathleen A. Schwarz, Ravishankar Sundararaman, 2013, Nano letters.

Transport of hot carriers in plasmonic nanostructures

William A. Goddard, Ravishankar Sundararaman, Harry A. Atwater, 2017, Physical Review Materials.