NERSC / openmp-series-2024
OpenMP Training Series, May to October 2024
☆17Updated 4 months ago
Alternatives and similar repositories for openmp-series-2024:
Users that are interested in openmp-series-2024 are comparing it to the libraries listed below
- GauXC is a modern, modular C++ library for the evaluation of quantities related to the exchange-correlation (XC) energy (e.g. potential, …☆30Updated 5 months ago
- Contains build scripts and instructions for software on a variety of UK HPC resources☆83Updated last week
- LSMS is a code for scalable first principles calculations of materials using multiple scattering theory.☆28Updated this week
- QMCPACK miniapp: a simplified real space QMC code for algorithm development, performance portability testing, and computer science experi…☆27Updated 7 months ago
- GPU-accelerated Quantum ESPRESSO using CUDA FORTRAN☆60Updated 5 years ago
- MultiResolution Chemistry☆31Updated last month
- Molecular dynamics proxy application based on Cabana☆20Updated 3 weeks ago
- RMG is an Open Source code for electronic structure calculations and modeling of materials and molecules. It is based on density function…☆48Updated this week
- Tensor Algebra Library Routines for Shared Memory Systems☆38Updated last year
- Exchange correlation (XC) library for density functional theory (DFT) calculations in modern C++☆19Updated last month
- MiniMD Molecular Dynamics Mini-App☆49Updated last week
- A scalable eigensolver for dense, symmetric (hermitian) matrices (fork of https://gitlab.mpcdf.mpg.de/elpa/elpa.git)☆30Updated last month
- ScaFaCoS library for Fast Coulomb Solvers☆29Updated 3 weeks ago
- ☆14Updated 2 years ago
- Open Source Exascale Computational Chemistry Software☆25Updated last month
- Code generator for simint vectorized integrals☆28Updated last year
- DBCSR: Distributed Block Compressed Sparse Row matrix library☆140Updated this week
- Molecular dynamics proxy application based on Kokkos☆32Updated 8 months ago
- ☆20Updated 3 months ago
- ☆19Updated 3 weeks ago
- Quantum Monte Carlo package, TurboRVB☆30Updated last week
- Standalone NECI codebase designed for FCIQMC and other stochastic quantum chemistry methods.☆45Updated last year
- OpenMP for Computational Scientists training materials☆24Updated 3 years ago
- A generic implementation of tensor einsum in Fortran.☆26Updated 4 years ago
- Library for Green’s function based electronic structure theory calculations☆23Updated this week
- Library for steering campaigns of simulations on supercomputers☆51Updated last month
- MultiResolution Computation Program Package☆12Updated this week
- Domain specific library for electronic structure calculations☆137Updated this week
- High-Performance configuration patterns and recipes.☆45Updated last week