Vikram Gavini

Publication Activity (10 Years)

Years Active: 2019-2024
Publications (10 Years): 13

Top Topics

Density Functional Theory

Top Venues

Journal of chemical theory and computation

The journal of physical chemistry letters

Science (New York, N.Y.)

Nature nanotechnology

This page only lists publications with an associated author ORCID identifier.

Publications

Bikash Kanungo, Aaron D Kaplan, Chandra Shahi, Vikram Gavini, John P Perdew
Unconventional Error Cancellation Explains the Success of Hartree-Fock Density Functional Theory for Barrier Heights. The journal of physical chemistry letters 15 (1) (2024)
Aaron D Kaplan, Chandra Shahi, Raj K Sah, Pradeep Bhetwal, Bikash Kanungo, Vikram Gavini, John P Perdew
How Does HF-DFT Achieve Chemical Accuracy for Water Clusters? Journal of chemical theory and computation 20 (13) (2024)
Vishal Subramanian, Sambit Das, Vikram Gavini
Tucker Tensor Approach for Accelerating Fock Exchange Computations in a Real-Space Finite-Element Discretization of Generalized Kohn-Sham Density Functional Theory. Journal of chemical theory and computation 20 (9) (2024)
Aaron D Kaplan, Chandra Shahi, Raj K Sah, Pradeep Bhetwal, Bikash Kanungo, Vikram Gavini, John P Perdew
How Does HF-DFT Achieve Chemical Accuracy for Water Clusters? Journal of chemical theory and computation (2024)
Bikash Kanungo, Aaron D Kaplan, Chandra Shahi, Vikram Gavini, John P Perdew
Unconventional Error Cancellation Explains the Success of Hartree-Fock Density Functional Theory for Barrier Heights. The journal of physical chemistry letters (2024)
Vishal Subramanian, Sambit Das, Vikram Gavini
Tucker Tensor Approach for Accelerating Fock Exchange Computations in a Real-Space Finite-Element Discretization of Generalized Kohn-Sham Density Functional Theory. Journal of chemical theory and computation (2024)
Bikash Kanungo, Nelson D Rufus, Vikram Gavini
Efficient All-Electron Time-Dependent Density Functional Theory Calculations Using an Enriched Finite Element Basis. Journal of chemical theory and computation (2023)
Bikash Kanungo, Nelson D Rufus, Vikram Gavini
Efficient All-Electron Time-Dependent Density Functional Theory Calculations Using an Enriched Finite Element Basis. Journal of chemical theory and computation 19 (3) (2023)
Bikash Kanungo, Jeffrey Hatch, Paul M Zimmerman, Vikram Gavini
Exact and Model Exchange-Correlation Potentials for Open-Shell Systems. The journal of physical chemistry letters (2023)
Bikash Kanungo, Paul M Zimmerman, Vikram Gavini
A Comparison of Exact and Model Exchange-Correlation Potentials for Molecules. The journal of physical chemistry letters 12 (50) (2021)
Roman Zhuravel, Haichao Huang, Georgia Polycarpou, Savvas Polydorides, Phani Motamarri, Liat Katrivas, Dvir Rotem, Joseph Sperling, Linda Angela Zotti, Alexander B Kotlyar, Juan Carlos Cuevas, Vikram Gavini, Spiros S Skourtis, Danny Porath
Backbone charge transport in double-stranded DNA. Nature nanotechnology 15 (10) (2020)
Harsha Reddy, Kun Wang, Zhaxylyk A Kudyshev, Linxiao Zhu, Shen Yan, Andrea Vezzoli, Simon J Higgins, Vikram Gavini, Alexandra Boltasseva, Pramod Reddy, Vladimir M Shalaev, Edgar Meyhofer
Determining plasmonic hot-carrier energy distributions via single-molecule transport measurements. Science (New York, N.Y.) 369 (6502) (2020)
Bikash Kanungo, Paul M Zimmerman, Vikram Gavini
Exact exchange-correlation potentials from ground-state electron densities. Nature communications 10 (1) (2019)