Kevin F. Garrity — National Institute of Standards and Technology

Area of research

Materials Chemistry · Atomic and Molecular Physics, and Optics

Research interest

Research interests include Electronic and Structural Properties of Oxides, Machine Learning in Materials Science, Topological Materials and Phenomena, and Ferroelectric and Piezoelectric Materials.

Recent publications

JARVIS-Leaderboard: a large scale benchmark of materials design methods

npj Computational Materials 2024cited by 48position: middledoi

Effects of octahedral tilting on the site of substitution of manganese in CaTiO3

Acta Materialia 2021cited by 19position: middledoi

Effects of Octahedral Tilting on the Site of Substitution of Manganese in CaTiO <sub>3</sub>

SSRN Electronic Journal 2020cited by 1position: middledoi

Reproducibility in density functional theory calculations of solids

Science 2016cited by 1,610position: middledoi

Antiferroelectricity in thin-film<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML"><mml:msub><mml:mrow><mml:mi mathvariant="normal">ZrO</mml:mi></mml:mrow><mml:mn>2</mml:mn></mml:msub></mml:math>from first principles

Physical Review B 2014cited by 279position: middledoi

Pseudopotentials for high-throughput DFT calculations

Computational Materials Science 2013cited by 1,586position: firstdoi

Ferroelectric surface chemistry: First-principles study of the PbTiO<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:msub><mml:mrow/><mml:mn>3</mml:mn></mml:msub></mml:math>surface

Physical Review B 2013cited by 99position: firstdoi

Grants

No grants ingested yet.

Frequent collaborators

Matthew P. Donohue · North Carolina State University2 papers (2020–2021)Igor Levin · University of Maryland, College Park2 papers (2020–2021)Karin M. Rabe · Rutgers Sexual and Reproductive Health and Rights2 papers (2013–2014)Russell A. Maier · Pennsylvania State University2 papers (2020–2021)Alexie M. Kolpak · Massachusetts Institute of Technology1 papers (2013–2013)Arvin Kakekhani · University of Pennsylvania1 papers (2013–2013)Joseph W. Bennett · University of Maryland, Baltimore County1 papers (2013–2013)Andrzej Ożarowski · Florida State University1 papers (2020–2020)Andrew Ozarowski · Florida State University1 papers (2021–2021)Giannantonio Cibin · University of York1 papers (2021–2021)David Vanderbilt · Rutgers, The State University of New Jersey1 papers (2013–2013)Sebastian E. Reyes‐Lillo · Universidad Andrés Bello1 papers (2014–2014)— · 1 papers (2013–2013)

Looking for a research collaborator?

Search millions of scientists by field, institution, impact, and funding status — see their work, find their email, and reach out directly.

Find collaborators in Materials Chemistry · Atomic and Molecular Physics, and Optics →