People

Raghunandan Pratoori

Iowa State University

Programs

ACCESS CSSN

Skills

Sanguthevar Rajasekaran

University of Connecticut

Programs

CAREERS

Skills

Portrait E.Riglioni

Emanuela Riglioni

Other

Programs

ACCESS CSSN

Skills

data-analysis monte-carlo machine-learning pytorch computational-chemistry materials-science particle-physics bash git ssh vim community-outreach project-management python r anaconda jupyterhub compiling

Paul Rulis

University of Missouri, Kansas City

Associate Professor of Physics

Programs

Campus Champions

Skills

dft machine-learning monte-carlo neural-networks vectorization parameter-sweeps random-numbers github metadata sftp storage core-dump cpu-bound debugging memory optimization parallelization performance-tuning profiling scaling scripting tuning checkpoint lammps molecular-dynamics paraview pytorch tensorflow materials-science quantum-mechanics comet gpu unix-environment batch-jobs core-hours job-accounting job-submission job-sizing pending-jobs schedulers scheduling slurm bash environment-modules git ssh tcp vim x11 permissions modules os proposal-development project-management research-grants software-carpentry xsede c c++conda fortran java programming openmp mpi programming-best-practices python sql putty encryption vpn terminal-emulation-and-window-management library-paths spack software-installation version-control singularity ai data-analysis computational-chemistry resources abstract affiliations citation xml dependencies

Mara Sedlins

Colorado State University

Data Management Specialist

Programs

RMACC

Skills

data-management r spss archiving data-lifecycle doi metadata

Nannan Shan

Purdue University

Senior Computational Scientist

Programs

CCMNet, ACCESS CSSN

Skills

George Mason University

Programs

ACCESS CSSN, CCMNet, Campus Champions

Skills

Emma Strand

University of Rhode Island

Programs

CAREERS

Skills

University of Central Florida

Computational Scientist

Programs

CCMNet, Campus Champions

Skills

computational-chemistry materials-science pbs slurm fortran bash modules ssh vim scripting ACCESS ACCESS-account ACCESS-allocations ACCESS-credits ACCESS-website adding-users sftp scratch globus

Roux Institute, Northeastern University

Associate Teaching Professor

Programs

Northeast, Campus Champions

Skills

Xuejing Wang

University of Massachusetts Dartmouth

Programs

CAREERS

Skills

materials-science finite-element-analysis git r arcgis python

Professor Kesong YANG

Kesong Yang

University of California, San Diego

Programs

ACCESS CSSN

Skills

expanse materials-science computational-chemistry python c++