People

Saritha Nellutla

Bridgewater State University

Programs

Northeast

Skills

computational-chemistry gaussian

Justin Oelgoetz

Austin Peay State University

Professor

Programs

Campus Champions, CCMNet

Skills

Alexander Pacheco

Lehigh University

Programs

Skills

computational-chemistry gaussian fortran spack open-ondemand condo tmux screen openmp bash research-facilitation xsede training git anaconda batch-jobs software-installation compiling conda

Deborah Penchoff

University of Tennessee - Knoxville

Programs

Campus Champions

Skills

ai deep-learning machine-learning neural-networks reinforcement-learning supervised-learning unsupervised-learning big-data computer-graphics data-analysis dft plotting visualization data-management data-sharing github github-pages benchmarking checkpoint cpu-bound memory parallelization performance-tuning scaling fluid-dynamics gaussian molecular-dynamics openfoam pytorch tensorflow cluster cluster-management cpu-architecture distributed-computing gpu hardware hpc-cluster-architecture hpc-operations lustre networking nvidia unix-environment bash environment-modules git ssh vim vm ACCESS ACCESS-account adding-users allocation-management allocation-time allocation-users anvil bridges-2 stampede2 stampede3 abstract affiliations citation community-outreach management mentorship professional-development project-management proposal-development publication-database research-facilitation research-grants training workforce-development xsede c++fortran jupyterhub mathematica matlab mpi openmp openmpi programming python r spark batch-jobs core-hours job-accounting job-submission pbs slurm biology computational-chemistry data-science quantum-mechanics data-compliance duo vpn spack version-control profile proposal-request

Lisa Perez

Texas A&M University

Director, High Performance Research Computing

Programs

SWEETER, ACCESS CSSN

Skills

computational-chemistry gaussian molecular-dynamics quantum-mechanics training

Mark Perri

Sonoma State University

Programs

Campus Champions

Skills

jetstream openstack computational-chemistry gamess namd quantum-mechanics science-gateway programming python docker

Edwin Posada

Temple University

Programs

Campus Champions

Skills

Spencer Pruitt

Worcester Polytechnic Institute

Programs

Northeast

Skills

batch-jobs computational-chemistry storage debugging distributed-computing hardware hpc-operations programming python scheduling slurm hpc-storage unix-environment mpi

Sanguthevar Rajasekaran

University of Connecticut

Programs

CAREERS

Skills

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

Nannan Shan

Purdue University

Senior Computational Scientist

Programs

CCMNet, ACCESS CSSN

Skills

Swabir Silayi

George Mason University

Programs

ACCESS CSSN, CCMNet, Campus Champions

Skills

Divjyot Singh

New Jersey Institute of Technology

Programs

Skills

data-analysis astrophysics quantum-mechanics computational-chemistry molecular-dynamics particle-physics matlab programming c++

Shawn Sivy

The College of New Jersey

HPC System Administrator

Programs

Campus Champions, CAREERS

Skills

Gil Speyer

Arizona State University

Scientific Software Engineer

Programs

ACCESS CSSN, RMACC, Campus Champions

Skills

parallelization optimization memory profiling scaling scripting debugging bioinformatics computational-chemistry quantum-mechanics bash training conda cuda c fortran matlab r gpu

Nandan Tandon

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

diana Trotman

Queens borough community college

Programs

CAREERS

Skills

data-analysis data-management-software data-transfer benchmarking cloud-open-source cloudlab research-grants community-outreach software-carpentry workforce-development biology computational-chemistry gamess cybersecurity programming-best-practices open-science-grid training

Scott Valcourt

Roux Institute, Northeastern University

Associate Teaching Professor

Programs

Northeast, Campus Champions

Skills

Kesong Yang

University of California, San Diego

Programs

ACCESS CSSN

Skills

expanse materials-science computational-chemistry python c++

People

Skills

Organization

Program