materials-science

Mentors and Regional Facilitators

Name	Region	Skills	Interests
Aya Nawano	CAREERS, ACCESS CSSN, Open OnDemand	lammps materials-science molecular-dynamics	anaconda bash batch-jobs benchmarking c c++ charmm compiling more...
Andres Ortiz Almazo	Campus Champions	administering-hpc ansible aws backup bash batch-jobs benchmarking c++ more...
Christopher Bl…		anaconda aws azure bash benchmarking c c++ cloud-commercial more...
Bala Desinghu	ACCESS CSSN, Campus Champions, CAREERS, Northeast	ai anaconda api bash batch-jobs benchmarking big-data bioinformatics more...	affinity-group ai allocations-proposal amber anaconda archiving backup bash more...
David Liu	CCMNet, ACCESS CSSN	abstract ACCESS ACCESS-account ACCESS-allocations account administering-hpc affiliations ai more...	ai cognitive-bias computer-vision deep-learning generative-ai llm machine-learning NAIRR-pilot more...
Ahmed Elrashidy	Campus Champions	ai bash computer-vision conda cp2k deep-learning generative-ai image-processing more...	anaconda computational-chemistry computer-vision condensed-matter data-science deep-learning generative-ai jupyterhub more...
Fernando Garzon	ACCESS CSSN	abstract ai aws bash batch-jobs big-data citation containers more...	ai aws azure bash batch-jobs big-data c c++ more...
Yu-Chieh Chi	Campus Champions	anaconda bash batch-jobs c c++ computational-chemistry containers cuda more...
Jonathan Lyon	At-Large, Campus Champions, Kentucky, ACCESS CSSN	bash computational-chemistry dft fortran gaussian materials-science quantum-mechanics	bash computational-chemistry dft fortran gaussian materials-science modules putty more...
Od Odbadrakh	ACCESS CSSN	ACCESS ACCESS-account ACCESS-allocations account affinity-group ai archiving bash more...	ACCESS account ai archiving bash batch-jobs benchmarking c more...
Marcus Bond	Great Plains, Campus Champions, CCMNet	bash centos computational-chemistry dft fortran gamess materials-science mentorship more...	atlas c gaussian gromacs hpc-cluster-architecture hpc-cluster-build hpc-getting-started hpc-operations more...
Nandan Tandon	CCMNet, Campus Champions	ACCESS ACCESS-account ACCESS-allocations ACCESS-credits ACCESS-website adding-users bash computational-chemistry more...	ACCESS allocations-proposal campus-champions materials-science professional-development research-facilitation training workforce-development
Nannan Shan	CCMNet, ACCESS CSSN	abstract ACCESS administering-hpc amber anaconda anvil api ase more...	ai aws azure cloud-computing containers data-science deep-learning kubernetes more...
Justin Oelgoetz	Campus Champions, CCMNet	abstract affiliations astrophysics bash benchmarking c c++ citation more...	administering-hpc ai amber astrophysics benchmarking c c++ charmm more...
Paul Rulis	Campus Champions	abstract affiliations ai bash batch-jobs c c++ checkpoint more...	abstract affiliations ai amber atlas bash batch-jobs benchmarking more...
Swabir Silayi	ACCESS CSSN, CCMNet, Campus Champions	amber anaconda bash batch-jobs benchmarking c c++ checkpoint more...	administering-hpc cluster-management
Simon Delattre		anaconda bash big-data conda data-transfer data-wrangling deep-learning machine-learning more...	bioinformatics
Torey Battelle	Campus Champions, CCMNet	administering-hpc batch-jobs computational-chemistry dft environment-modules fortran lmod materials-science more...	administering-hpc anaconda benchmarking cluster-management computational-chemistry cui dft environment-modules more...
Uthpala Herath	ACCESS CSSN	ACCESS administering-hpc affiliations ai anaconda api artificial-intelligence automation more...	ACCESS administering-hpc affiliations ai anaconda api artificial-intelligence arts more...

Users

Name	Roles	Skills	Interests
Bala Desinghu	mentor researcher/educator rcf	ai anaconda api bash batch-jobs benchmarking big-data bioinformatics more...	affinity-group ai allocations-proposal amber anaconda archiving backup bash more...
Jonathan Lyon	mentor researcher/educator	bash computational-chemistry dft fortran gaussian materials-science quantum-mechanics	bash computational-chemistry dft fortran gaussian materials-science modules putty more...

Projects

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Blog Entries

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Organizations

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ERN

Website

https://www.ernrp.org

big-data data-access-protocols data-compliance data-management data-analysis

Affinity Groups

There are no Affinity Groups associated with this topic. View All Affinity Groups.

Announcements

Title	Date
Ookami Webinar	02/14/24
Open Call: Minisymposia for PASC24	10/05/23

Upcoming Events & Trainings

No events or trainings are currently scheduled.

Topics from Ask.CI

Knowledge Base Resources

Title	Category	Tags	Skill Level
MDAnalysis - Python library for the analysis of molecular dynamics simulations	Tool	computational-chemistry, materials-science, python	Beginner, Intermediate, Advanced
OnShape FeatureScripts: Custom features for everyone	Tool	documentation, materials-science, particle-physics	Intermediate, Advanced

People with Expertise

Bala Desinghu

Harvard University

Programs

ACCESS CSSN, Campus Champions, CAREERS, Northeast

Roles

mentor, researcher/educator, research computing facilitator, cssn, Consultant

Expertise

anaconda

api

bash

batch-jobs

+84 more tags

People with Interest

Wirawan Purwanto

Old Dominion University

Programs

Campus Champions, Northeast, ACCESS CSSN, CCMNet

Roles

mentor, research computing facilitator, cssn, CCMNet

Interests

bash

batch-jobs

benchmarking

big-data

+100 more tags

Bala Desinghu

Harvard University

Programs

ACCESS CSSN, Campus Champions, CAREERS, Northeast

Roles

mentor, researcher/educator, research computing facilitator, cssn, Consultant

Interests

affinity-group

allocations-proposal

amber

anaconda

+115 more tags