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Profiles

The Group

Members

Krishnan Raghavachari

Principal Investigator

About Krishnan

Surya Manna

Postdoctoral Fellow

Email:: ssmanna@iu.edu

Area(s) of Study: Machine Learning in Chemistry, CAD of Fluorescent Materials, Protein Ligand Binding

Sarah Maier

Graduate Student

Area(s) of Study: Fragmentation Methods

Minwei Che

Graduate Student

Area(s) of Study: Fragmentation Methods

Alec Sanchez

Graduate Student

Area(s) of Study: Fragmentation Methods

Debashis Swain

Graduate Student

Area(s) of Study: Machine Learning in Chemistry

Shubham Singh

Graduate Student

Area(s) of Study: Machine Learning in Chemistry, CAD of Fluorescent Materials

Deep J. Sapkota

Graduate Student

Area(s) of Study: Machine Learning in Chemistry, CAD of Fluorescent Materials

Vikrant Tripathy

Former Member

Sruthy Chandy

Former Member

Area(s) of Study: Development of MIM-Fragmentation methods for the NMR chemical shift predictions of large Biomolecules, Metal-Nanographene catalysis for carbon dioxide reduction

Eric Collins

Former Member

Area(s) of Study: Thermochemistry, Machine Learning, Fragmentation Method Development

Ankur Kumar Gupta

Former Member

Current Position: Postdoctoral Researcher at Lawrence Berkeley National Lab

Sibali Debnath

Former Member

Area(s) of Study: Fragmentation Methods

Tumpa Sadhukhan

Former Member

Bishnu Thapa

Former Member

Area(s) of Study: Fragmentation Methods

Daniel Beckett

Former Member

Area(s) of Study: Molecular Properties Through Fragmentation Method

Corrine Kumar

Former Member

Area(s) of Study: Metal Oxide Chemistry

Richard Schaugaard

Former Member

Arkajyoti Sengupta

Former Member

Area(s) of Study: Thermochemistry of Organic molecules

Benjamin Noffke

Former Member

Area(s) of Study: Structure and Reactivity of Graphenes

Manisha Ray

Former Member

Current Position: Assistant Professor at Loyola University

Jovan Jose K.V.

Former Member

Area(s) of Study: Development of Hybrid QM:QM Charge Transfer Methods

Marc Edelmann

Former Member

Area(s) of Study: Fragmentation Methods

Arjun Saha

Former Member

Area(s) of Study: Fragmentation Method & Reactivity of Transition Metal Oxides

Deyaa AbuSalim

Former Member

Area(s) of Study: Organic Synthesis and Reaction Mechanisms

Benjamin Gamoke

Former Member

Area(s) of Study: Silicon Surface Chemistry

Raghunath Ramabhadran

Former Member

Current Position: Assistant Professor at Indian Institute of Science Education and Research, Tirupati

Victoria Erdely

Former Member

Area(s) of Study: Reactivity of Transition Metal Oxide

Aliaksandr Krukau

Former Member

Edwin Becher

Former Member

Area(s) of Study: Metal Oxide Chemistry

Arefin Chowdhury

Former Member

Area(s) of Study: Metal Oxide and Sulfide Chemistry

Nick Mayhall

Former Member

Area(s) of Study: QM:QM method development, Fragmentation Methods, Gas-Phase Cluster Chemistry, Transition Metal Thermochemistry

P R

Parthasarathi Ramakrishnan

Former Member

G F

Glen A. Ferguson

Former Member

C T

Christopher Than

Former Member

H H

Hrant P. Hratchian

Former Member

U D

Ujjal Das

Former Member

P P

Priya Parandekar

Former Member

I B

Indrajit Bandyopadhyay

Former Member

M H

Mathew D. Halls

Former Member