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2021 HybriD3 Theory Training Workshop

Jan 19

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Tuesday, January 19, 2021 - 9:10am to Friday, January 22, 2021 - 9:10am


Volker Blum (MEMS) and Yosuke Kanai (UNC) and others

This workshop introduces PhD students and other early-career scientists to the theory and practical applications of atomistic modeling techniques in materials science, chemistry, and condensed matter physics, particularly first-principles electronic structure calculations. We will offer a three-day program of lectures and simple hands-on sessions, designed to provide an entry point to the current most important, density-functional theory based simulation approaches in computational molecular and materials science. The workshop is offered as part of the NSF-DMREF funded "HybriD3" consortium (DMR-1728921/1729297/1729383) in support of the Materials Genome Initiative and the NSF Software Infrastructure for Sustained Innovation program. Registration: We ask you to register in advance at our registration page . A Zoom link for the training workshop will be sent out ahead of the workshop. Please indicate whether or not you plan to participate in the hands-on tutorials. Space for participation in the hands-on tutorial sessions will be limited for logistical reasons.