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Search results for "density functional"

Viewing 1 - 20 of 115 results by relevance
Consensus Study Report

Computational and Theoretical Techniques for Materials Science  (1995)

Mathematical Research in Materials Science: Opportunities and Perspectives  (1993)

Proceedings

Frontiers in Data Analytics and Monitoring Tools for Extreme Materials: Proceedings of a Workshop  (2023)

Mathematical Challenges from Theoretical/Computational Chemistry  (1995)

Consensus Study Report

An Assessment of the National Institute of Standards and Technology Center for Neutron Research: Fiscal Year 2015  (2015)

Consensus Study Report

Condensed-Matter Physics  (1986)

Consensus Study Report

Materials Science and Technology: Challenges for the Chemical Sciences in the 21st Century  (2003)

Proceedings

Innovations in Catalysis to Address Modern Challenges: Proceedings of a Workshop–in Brief  (2023)

Consensus Study Report

NSF Efforts to Achieve the Nation's Vision for the Materials Genome Initiative: Designing Materials to Revolutionize and Engineer Our Future (DMREF)  (2023)

Proceedings

Empowering Tomorrow's Chemist: Laboratory Automation and Accelerated Synthesis: Proceedings of a Workshop–in Brief  (2022)

Proceedings

High-Entropy Materials, Ultra-Strong Molecules, and Nanoelectronics: Emerging Capabilities and Research Objectives: Proceedings of a Workshop  (2019)

Consensus Study Report

An Assessment of the National Institute of Standards and Technology Center for Nanoscale Science and Technology: Fiscal Year 2009  (2009)

Consensus Study Report

Catalysis for Energy: Fundamental Science and Long-Term Impacts of the U.S. Department of Energy Basic Energy Sciences Catalysis Science Program  (2009)

Consensus Study Report

Scientific Opportunities with a Rare-Isotope Facility in the United States  (2007)

Proceedings

Predictive Theoretical and Computational Approaches for Additive Manufacturing: Proceedings of a Workshop  (2016)

Proceedings

Novel Processes for Advanced Manufacturing: Summary of a Workshop  (2013)

Consensus Study Report

Nuclear Physics: Exploring the Heart of Matter  (2013)

Proceedings

Data Analytics and What It Means to the Materials Community: Proceedings of a Workshop  (2021)

Consensus Study Report

Advancing Chemistry and Quantum Information Science: An Assessment of Research Opportunities at the Interface of Chemistry and Quantum Information Science in the United States  (2023)

Consensus Study Report

Information and Communications: Challenges for the Chemical Sciences in the 21st Century  (2003)