The Computational Materials Repository

David D. Landis, Jens S. Hummelshøj, Svetlozar Nestorov, Jeff Greeley, Marcin Dulak, Thomas Bligaard, Jens K. Nørskov, Karsten W. Jacobsen

Research output: Contribution to journalJournal articleResearchpeer-review

Abstract

The possibilities for designing new materials based on quantum physics calculations are rapidly growing, but these design efforts lead to a significant increase in the amount of computational data created. The Computational Materials Repository (CMR) addresses this data challenge and provides a software infrastructure that supports the collection, storage, retrieval, analysis, and sharing of data produced by many electronic-structure simulators.
Original languageEnglish
JournalComputing in Science & Engineering
Volume14
Issue number6
Pages (from-to)51-57
ISSN1521-9615
DOIs
Publication statusPublished - 2012

Fingerprint Dive into the research topics of 'The Computational Materials Repository'. Together they form a unique fingerprint.

Cite this