Vijay Gopal Chilkuri

Publication Activity (10 Years)

Years Active: 2017-2024
Publications (10 Years): 7

Top Topics

Iron Deficiency

Density Functional Theory

Molecular Dynamics

Energy Transfer

Top Venues

Inorganic chemistry

The Journal of chemical physics

Journal of computational chemistry

Journal of chemical theory and computation

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

Publications

Leo Chaussy, Vijay Gopal Chilkuri, Stéphane Humbel, Paola Nava
Spectroscopy of End-On Copper(II) Superoxido Complexes: A Wave Function-Based Analysis. Inorganic chemistry 63 (18) (2024)
Leo Chaussy, Vijay Gopal Chilkuri, Stéphane Humbel, Paola Nava
Spectroscopy of End-On Copper(II) Superoxido Complexes: A Wave Function-Based Analysis. Inorganic chemistry (2024)
Evgeny Posenitskiy, Vijay Gopal Chilkuri, Abdallah Ammar, Michał Hapka, Katarzyna Pernal, Ravindra Shinde, Edgar Josué Landinez Borda, Claudia Filippi, Kousuke Nakano, Otto Kohulák, Sandro Sorella, Pablo de Oliveira Castro, William Jalby, Pablo López Ríos, Ali Alavi, Anthony Scemama
TREXIO: A file format and library for quantum chemistry. The Journal of chemical physics 158 (17) (2023)
Vijay Gopal Chilkuri, Frank Neese
Comparison of many-particle representations for selected-CI I: A tree based approach. Journal of computational chemistry 42 (14) (2021)
Vijay Gopal Chilkuri, Frank Neese
Comparison of Many-Particle Representations for Selected Configuration Interaction: II. Numerical Benchmark Calculations. Journal of chemical theory and computation 17 (5) (2021)
Vijay Gopal Chilkuri, Serena DeBeer, Frank Neese
Ligand Field Theory and Angular Overlap Model Based Analysis of the Electronic Structure of Homovalent Iron-Sulfur Dimers. Inorganic chemistry 59 (2) (2019)
Vijay Gopal Chilkuri, Serena DeBeer, Frank Neese
Revisiting the Electronic Structure of FeS Monomers Using ab Initio Ligand Field Theory and the Angular Overlap Model. Inorganic chemistry 56 (17) (2017)