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@ToAmano
ToAmano
@sweetmixture
WOONGKYU JEE sweetmixture
Research Software Engineer at UCL Theor. & Compt. Chem.

University College London KLB, Euston, London

@IMPDGroup
IMPD Group IMPDGroup
Our research focuses on the Integrated Materials and Processes Design, a combination of engineering design and materials science.

Worcester Polytechnic Institute Worcester, MA, USA

@learningmatter-mit
Learning Matter @ MIT learningmatter-mit
Rafael Gomez-Bombarelli Group @ MIT
@buaa-hipo
High Performance Cross-Stack Optimization (HiPO) buaa-hipo
Our group works in the field of high performance computing, with a particular interest in across-stack optimizations
@amchecker
amchecker
@M5-Lab
M5 Lab -- Carnegie Mellon University M5-Lab
@bdice
Bradley Dice bdice
Scientific software developer, working on @rapidsai cuDF and RMM. Python, C++, CUDA, algorithms & data. PhD in Physics & Scientific Computing from @glotzerlab.

@NVIDIA @rapidsai Kansas City, MO

@rfhari
Hariharan Ramasubramanian rfhari
PhD student at CMU Mechanical Engineering
@Bukowski-Research-Group
Bukowski Research Group Bukowski-Research-Group
We are a computational research group at Johns Hopkins dedicated to developing sustainable new catalysts

United States of America

@enrdrigo
Enrico Drigo enrdrigo
PhD Fellow in Condensed Matter Physics @ SISSA
@shirtsgroup
Shirts Research Group shirtsgroup

University of Colorado Boulder

@chunlinxuizz
Chunlin Xu chunlinxuizz
I am a Ph.D. student in Theoretical and Computational Chemistry at the Department of Chemistry, Tsinghua University.

Tsinghua University Beijing

@k-rao
Karthik Rao k-rao
@singraber
Andreas Singraber singraber
@akohlmey
Axel Kohlmeyer akohlmey
I work as Professor of Research at Temple University in Philadelphia, PA and am head of a small team that manages HPC clusters

Temple University Philadelphia PA

@ColdSnaap
ColdSnaap
@Lingyu-Kong
Lingyu Kong Lingyu-Kong
CSE PhD in Georgia Tech, interested in Machine Learning and AI4Science

Georgia Institute of Technology Atlanta

@sgao42
Shiyuan Gao sgao42
@afiorent
Alfredo Fiorentino afiorent
@ppegolo
Paolo Pegolo ppegolo
PostDoc at @lab-cosmo EPFL
@Exabyte-io
Mat3ra.com Exabyte-io
Materials R&D Cloud

San Francisco, CA, USA

@divelab
DIVE Lab, Texas A&M University divelab
Data Integration, Visualization, and Exploration

United States of America

@caileisir
CaiLei caileisir
@FlemkMeserath
Francesco Belli FlemkMeserath
@compgeolab
Computer-Oriented Geoscience Lab compgeolab
Geophysical research powered by open-source software

Brazil

@ML-AMD
ML-AMD ML-AMD
Accelerating the discovery and design of advanced magnetic and superconducting materials using AI/ML and Exascale computing.
@zhuyizhou
Yizhou Zhu zhuyizhou

School of Engineering, Westlake University

@dongxianchao
dongxianchao
@ejmeitz
Ethan Meitz ejmeitz
PhD Student -- Carnegie Mellon University
@liangnj
liangnj
@faridf
Seyyedfaridoddin Fattahpour faridf
@autoatml
autoatml
@lammps
LAMMPS Developers lammps
Development of the LAMMPS Molecular Dynamics Simulator and Related Projects

United States of America

@wtransue
wtransue
@artem78
Artem artem78
Not a developer, programmer or related with it in any way

Russia

@petenez
Petri Hirvonen petenez
I am a fresh D.Sc. (Tech.) who has studied two-dimensional materials using phase field crystal (PFC) models. I'm interested in computer modeling in general.

Varian Medical Systems Espoo/Helsinki

@Zhang-Jiayong
Zhang-Jiayong
@CCP-NC
CCP-NC CCP-NC
The Collaborative Computational Project for NMR Crystallography
@Bin-Cao
barnie曹斌 Bin-Cao
PhD in HKUST(GZ), working on machine learning for Spectroscopy and Crystallography

HongKongUST @WPEM @Bgolearn Guangzhou

@Shiliang2333
Shiliang2333

Huazhong University of Science and Technology WuHan，China

@DiamondLightSource
Diamond Light Source DiamondLightSource
Diamond Light Source is the UK’s national synchrotron science facility, located at the Harwell Science and Innovation Campus in Oxfordshire.
@pymc-devs
PyMC pymc-devs
@huiju-lee
Huiju Lee huiju-lee

Portland State University Portland, OR

@mantidproject
Mantid Project mantidproject
@NoPolyScience
NoPolyScience
@glotzerlab
Glotzer Group glotzerlab
We develop molecular simulation tools to study the self-assembly of complex materials and explore matter at the nanoscale.

University of Michigan

@Fung-Lab
Fung Group Fung-Lab
AI for materials discovery group at Georgia Tech CSE

United States of America

@adpozuelo
Antonio Díaz Pozuelo adpozuelo
@xianglinliu01
xianglinliu01