JC
James Chelikowsky
The University of Texas at Austin, University of California, Berkeley
Research areas: Physics and Astronomy · Atomic and Molecular Physics, and Optics · Advanced Chemical Physics Studies · Surface and Thin Film Phenomena · Semiconductor materials and interfaces
0000-0003-2181-3070
Employment
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The University of Texas at Austin W.A. Moncrief Jr. Chair of Computational Materials2005 - Present
Education
- 1970 - 1975
Projects & Funding
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DMREF:SusChEM:Collaborative Research: Design and Synthesis of Novel Magnetic Materials National Science Foundation - Directorate for Mathematical & Physical Sciences2014 - 2017
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Scalable Computational Tools for Discovery and Design: Excited State Phenomena in Energy Materials Department of Energy, Office of Science2012 - 2017
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Computational Theory Applied to Nanostructures Department of Energy, Office of Science2006 - 2019
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High Performance Algorithms for Electronic Materials National Science Foundation - Directorate for Mathematical & Physical Sciences1999 - 2002
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Massively Parallel Algorithms for Modeling the Structure of Liquids and Liquid-Solid Interfaces National Science Foundation - Directorate for Mathematical & Physical Sciences1992 - 1997
Publications (37)
- Machine-learning-guided high-throughput discovery of rare earth-free Fe-Co-S magnets Save
- High-pressure structure-property relations of oP32−Ge Save
- Real-Space Stochastic GW Calculations Benchmark on GW20 Save
- AI-driven and quantum-informed searches for rare-earth free magnets: Applications to Fe–Co–X (X=B, C, P, Si, S) compounds Save
- Topological and chiral phonons in two-dimensional transitional metal monocarbide monolayers Save
- Accelerated discovery and design of Fe-Co-Zr magnets with tunable magnetic anisotropy through machine learning and parallel computing Save
- Decoding atomic landscapes: Integrating electronic structure theory and high-resolution atomic force microscopy Save
- Real space simulation for state-resolved high-resolution atomic force microscopy of defects in monolayer h-BN Save
- Role of doping in probe microscopies for the Si(111) 7×7 surface Save
- Machine learning assisted search for Fe–Co–C ternary compounds with high magnetic anisotropy Save
- Efficient Full-Frequency GW Calculations Using a Lanczos Method Save
- Pressure-induced superconductivity in a novel germanium allotrope Save
- Anisotropy and isotope effect in superconducting solid hydrogen Save
- Roadmap on electronic structure codes in the exascale era Save
- Real-space solution to the electronic structure problem for nearly a million electrons Save
- Solving the electronic structure problem for over 100 000 atoms in real space Save
- Magnetic iron-cobalt silicides discovered using machine-learning Save
- Observation of electron orbital signatures of single atoms within metal-phthalocyanines using atomic force microscopy Save
- Accelerating the discovery of novel magnetic materials using machine learning–guided adaptive feedback Save
- Out-of-plane polarization and topological magnetic vortices in multiferroic CrPSe3 Save