Rohit Goswami

PeerJ Author & Reviewer

Summary

Currently working on computational methods and algorithm development. My focus is on molecular simulation analysis, large scale computational photonics, and algorithmic design of efficient HPC software.

Algorithms & Analysis of Algorithms Cluster Chemistry Computational Science Data Mining & Machine Learning Distributed & Parallel Computing Kinetics & Reactions Molecular Biology Photochemistry Scientific Computing & Simulation Spectroscopy Statistics Theoretical & Computational Chemistry Thermodynamics & Statistical Mechanics

Past or current institution affiliations

Indian Institute of Technology, Kanpur

University of Iceland

Work details

Doctoral Researcher

University of Iceland

November 2019

Faculty of Physical Sciences

Project Associate

Indian Institute of Technology, Kanpur

July 2018 - June 2019

Chemical Engineering

I was associated with the Computational Nanoscience group. Over the course of two centrally funded projects, ``Nucleation On Nanostructured Surfaces Computer Simulation Studies (SPO/DST/CHE/2017294)'' and ``Advanced Computation Research and Education (SPO/MHRD/CC/20130176)'': - I worked on the implementation of an enhanced version of the CHILL (CHILL+) algorithm for tracking ice types. - Designed a linear discriminant analysis technique for near-surface ice structure determination which is undergoing rigorous testing - Implemented a graph based network connectivity model for ice structures - Spearheaded the development of High Performance GPU accelerated molecular dynamics simulation analysis tools - Worked on the determination of optimal GPU cluster configurations - Designed and administered academic outreach websites

Senior Project Associate

Indian Institute of Technology, Kanpur

July 2019 - January 2021

Chemistry

I was affiliated to the Femtolab under the project “Femtosecond Laser Approaches to Quantum Information and Quantum Computation (SPO/MEITY/CHM/2018356)” I also worked on computational photonics, as well as ultrafast techniques for chemical process industries.