Sandeep Sharma

25PUBLICATIONS

44CO-AUTHORS

Radiation and matterTheoretical quantum chemistryStatistical mechanics in chemistryData structures and algorithmsFree radical chemistry

Get your video featured.

Publish with JoVE

Get your video featured.

Publish with JoVE

Publications (25)

Sort by Publication Date:

|Jul 01, 2026

Nuclear Gradients from Auxiliary-Field Quantum Monte Carlo and Their Applications in ML-Driven Geometry Optimization and Transition State Search.

|Jan 23, 2026

Excited states in auxiliary field quantum Monte Carlo.

Ankit Mahajan, Sandeep Sharma, Shiwei Zhang

|Feb 05, 2025

Beyond CCSD(T) Accuracy at Lower Scaling with Auxiliary Field Quantum Monte Carlo.

Ankit Mahajan, James H Thorpe, Jo S Kurian

|Dec 04, 2024

Fast and spectrally accurate construction of adaptive diagonal basis sets for electronic structure.

Michael Lindsey, Sandeep Sharma

|Aug 26, 2024

Use of Multigrids to Reduce the Cost of Performing Interpolative Separable Density Fitting.

Kori E Smyser, Alec White, Sandeep Sharma

|Dec 19, 2023

Toward Linear Scaling Auxiliary-Field Quantum Monte Carlo with Local Natural Orbitals.

Jo S Kurian, Hong-Zhou Ye, Ankit Mahajan

Pageof 5

Frequent Collaborators

Ankit Mahajan

James E T Smith

David R Reichman

Jo S Kurian

Xubo Wang

Seunghoon Lee

Yuki Kurashige

Bastien Mussard

Paul M Zimmerman

Iliya Sabzevari

Frequent Collaborators

Ankit Mahajan

James E T Smith

David R Reichman

Jo S Kurian