David Rogers is a computational scientist with 12 years of experience applying high-performance computing, parallel programming, and statistical mechanics to multiscale modeling problems in chemistry and materials. Based at Oak Ridge National Laboratory, he develops scalable libraries and interfaces that bring open-source tools to large-scale simulations of fluids, interfaces, and nanoscale devices. His background spans academia and national labs—from a PhD in physical chemistry to postdoctoral work at Sandia and a faculty role at USF—giving him deep domain expertise in thermodynamics, hydration, and nonequilibrium systems. An active contributor to spack, he has improved package builds and added CUDA/Kokkos support for HPC packages like LAMMPS and dealii, reflecting a knack for performance engineering and reproducible computational environments. Colleagues rely on him to bridge rigorous theory with practical software engineering to enable new modeling capabilities at scale.
12 years of coding experience
7 years of employment as a software developer
PhD, Physical Chemistry, PhD, Physical Chemistry at University of Cincinnati
A flexible package manager that supports multiple versions, configurations, platforms, and compilers.
Role in this project:
Backend Engineer
Contributions:17 reviews, 8 commits, 20 PRs in 2 years 9 months
Contributions summary:David primarily contributed to the package management aspects of the repository, focusing on specific packages and their build configurations. They modified existing package definitions, particularly for the LAMMPS and dealii packages, to incorporate new features like CUDA and Kokkos support. Additionally, they addressed build issues by fixing compiler flag configurations within the hypre package and adding dependencies. The user also added a new package for the sparrow project.
A flexible package manager that supports multiple versions, configurations, platforms, and compilers.
Contributions:62 pushes, 16 branches in 4 years 1 month
compilersmacrosplatformspackage-managerdarwin
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