Density-functional theory

Aloysius Soon

Yonsei University

Faculty Member

Materials science and engineering Department

Computational Chemistry, Computational Materials Science, Computational Modelling, and Computational Nano Physics

Andriy Zakutayev

National Renewable Energy Laboratory

Post-Doc

National Center for Photovoltaics

Combinatorial Optimization, Defects in Semiconductors, Transition-Metal Oxides, and Transparent Conducting Oxide Materials

Lucas Fernández Seivane

University of Texas at San Antonio

Post-Doc

Physics and Astronomy Department

Density-functional theory, High Performance Computing, Metal clusters, and Nanoscience and nanotechnology

Damian Allis

Syracuse University

Faculty Member

Chemistry Department

Computational Chemistry, Density-functional theory, Dna Nanotechnology, and Drumming and Percussion

Stefano Sanvito

Trinity College Dublin

Faculty Member

School of Physics

Computational Physics, Density-functional theory, Organic Spintronics, and Quantum Transport

David O'Regan

Ecole Polytechnique Federale de Lausanne

Post-Doc

School of Engineering (STI)

Computational Physics, Condensed Matter Physics, Density-functional theory, and Geometry And Topology

Aurab Chakrabarty

Max Planck Institute for Iron Research

Post-Doc

Computational Materials Design Department

Computational Physics, Defects in Semiconductors, Density-functional theory, and Hydrogen Embrittlement

Iqbal Latif

IIT Bombay

Graduate Student

Chemistry Department

Computational Chemistry, Density-functional theory, Quantum Chemistry, and Theoretical Chemistry

Sharat Chandra

Indira Gandhi Centre for Atomic Research

Faculty Member

Materials Science Group Department

Chemical Physics, Computational Chemistry, Computational Materials Science, and Computational Nano Physics

Gobinda Gopal Khan

S. N. Bose National Centre for Basic Sciences

Post-Doc

Materials Science Department

Condensed Matter Physics, Density-functional theory, and Nanomaterials

C.A. Palma

MPI for Polymer Research

Post-Doc

Synthetische Chemie Department

Heteregeneous Catalysis (in Chemistry/Catalysis); Nanotechnology, Molecular Dynamics Simulation, Molecular Electronics, and Molecular Engineering

Preethi Meher Srinivasan

Indian Institute of Science

Graduate Student

Materials Research Center

Crystallography, Density-functional theory, Magnetic Materials, and Materials Science

Tapajyoti Das Gupta

Ecole polytechnique

Undergraduate

Physics Department

Condensed Matter Physics, Density-functional theory, Dmft, and Materials Engineering

Vasu Kuraganti

University of Hyderabad

Graduate Student

School of Physics

Condensed Matter Physics, Density-functional theory, Materials Science, and Nanomaterials Characterization

Lutz Ackermann

University of Limpopo

Faculty Member

Materials Modelling Center

Atomic and Molecular Physics, Baterys' Electrodes, Chaos (Physics), and Composites (Chemistry)

Ricardo M. Ribeiro

Universidade do Minho

Faculty Member

Centro de Física Department

Computational Materials Science, Computational Physics, Density-functional theory, and Graphene

Sam Vinko

University of Oxford

Post-Doc

Atomic and Laser Physics Department

Computational Materials Science, Condensed Matter Physics, Density-functional theory, and Experimental Condensed Matter

Alper İnce

Middle East Technical University

Graduate Student

Micro And Nanotechnology Department

Biomass to fuel conversion, Density-functional theory, Heterogeneous Catalysis, and Mathematical Modeling

Ricardo Grau-Crespo

University College London

Faculty Member

Department of Chemisty

Computational Materials Science, Density-functional theory, Heteregeneous Catalysis, and Statistical Mechanics

V Sitaram

Indian Institute of Science

Graduate Student

Physics Department

Ab initio calculations, Conducting Polymers, Density-functional theory, and Polyaniline

Nicholas Hine

Imperial College London

Post-Doc

Materials Department

Carbon Nanotubes, Density-functional theory, Materials Science, and Materials Science, Electronic Transport, Colossal Magneto Resistance Materials, Semiconductor Devices Simulation, Oxides Thin Films, Ceramic Oxides

Acharya KLN

SASTRA University

Graduate Student

ECE Department

Calculus of Variations, Hetrojuctions for Semiconductors, Lattice Dyanmics, and Lattice Theory

Sonu Kumar

Indian Institute of Technology Delhi

Graduate Student

Physics Department

Ab-Intio Study of Phonons, Density-functional theory, phonons in oxides using DFT, and Computational Materials Science

Mihir Khadilkar

Cornell University

Graduate Student

Physics Department

Computational Physics, Condensed Matter Physics, and Density-functional theory
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