Pinned Repositories
DavidsonJCP
Files for the examples in "Mesh Independence of the Generalized Davidson Algorithm" by Kelley, Bernholc, Briggs, Hamilton, Lin, and Yang
rmgdft
RMG is an Open Source code for electronic structure calculations and modeling of materials and molecules. It is based on density functional theory and uses a real space basis and pseudopotentials.
spack
A flexible package manager that supports multiple versions, configurations, platforms, and compilers.
Tiled-MM
Matrix multiplication on GPUs for matrices stored on a CPU. Similar to cublasXt, but ported to both NVIDIA and AMD GPUs.
Tiled-MM
Matrix multiplication on GPUs for matrices stored on a CPU. Similar to cublasXt, but ported to both NVIDIA and AMD GPUs.
adaptive-finite-differencing
Input and output files/data for AFD
rmgdft
RMG is an Open Source code for electronic structure calculations and modeling of materials and molecules. It is based on density functional theory and uses a real space basis and pseudopotentials.
rmgwebinterface
RMG web based input file generator. Click the following link to try. https://share.streamlit.io/rmgdft/rmgwebinterface/main/main.py
ROCm
AMD ROCm™ Software - GitHub Home
spack
A flexible package manager that supports multiple versions, configurations, platforms, and compilers.
elbriggs's Repositories
elbriggs/rmgdft
RMG is an Open Source code for electronic structure calculations and modeling of materials and molecules. It is based on density functional theory and uses a real space basis and pseudopotentials.
elbriggs/spack
A flexible package manager that supports multiple versions, configurations, platforms, and compilers.
elbriggs/Tiled-MM
Matrix multiplication on GPUs for matrices stored on a CPU. Similar to cublasXt, but ported to both NVIDIA and AMD GPUs.