Nannan Shan
Bio
Prior to joining the RCAC team in 2022, Nannan's research area was utilizing both multiscale simulations (e.g. DFT and MD) and experiments to accelerate the functional materials discovery and innovation in the fields of surface science, catalysis and energy production and storage.
Equipped with broad scientific knowledge and hands-on experience in Chemical Engineering, Materials Science, and Chemistry, Nannan is devoting her passion to s...
Skills
computational-chemistrymaterials-sciencegamessgaussiangromacslammpsmolecular-dynamicsnamdpytorchtensorflowasecp2kcharmmamberdocumentationlicenseloginticketsauthenticationdata-analysismonte-carlovisualizationdata-transferglobussftpbenchmarkingcheckpointscalingparallelizationopen-ondemandscience-gatewayapiadministering-hpccluster-supportgpuunix-environmentbashenvironment-modulesgitmodulessshvimACCESSanvilabstractcitationmentorshipprofessional-developmentproject-managementproposal-developmentresearch-grantstraininganacondajupyterhubmathematicapythonscikit-learnbatch-jobsslurmjob-arraypbscentosspackdftpip
Interests
Affinity Groups
Knowledge Base Contributions
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Nannan Shan
Purdue University
Senior Computational Scientist
CSSN Member
Roles:
Affinity Group Leadermentor
research computing facilitator
research software engineer
researcher/educator
cssn
Consultant