Pinned Repositories
aiowire
aiowire - A simple event loop using asyncio
chan9
Fork of the go9p library at code.google.com/p/go9p
EwaldCorrel
Simultaneous Implementation of Smooth Particle Mesh Ewald summation and Fourier Space Correlation Calculations
hirshfeld
Hirshfeld Analysis module for PySCF
libdag
GNU-C and Posix Thread Library for Parallel Execution of Task Graphs
mpi_list
A package for working with lists distributed over MPI
pbctools
Development version of the pbctools plugin for VMD.
rbtree
C Implementation of Red/Black Trees
spackCF
Spack Wrapper for Compute Facilities
frobnitzem's Repositories
frobnitzem/libdag
GNU-C and Posix Thread Library for Parallel Execution of Task Graphs
frobnitzem/indysccapi
A REST API for Programming Competition Results
frobnitzem/scicomp-recipes
Recipes for Scientific Computing
frobnitzem/autoQCT
Automated QCT Analysis
frobnitzem/BDAS
Parallel Core Data Analytics Methods in Python/Numpy/Cupy/Mpi4Py
frobnitzem/classifier
Monte Carlo Sampler for Bernoulli Mixture Models
frobnitzem/hello-numerical-world-2021-06-isc
frobnitzem/hpl-hpcg
HPL & HPCG Walkthrough
frobnitzem/realpole
Code for real-space quadrature representation of multipole expansions
frobnitzem/accfft
A Massively Parallel FFT Library for CPU/GPU
frobnitzem/alpaka
Abstraction Library for Parallel Kernel Acceleration :llama:
frobnitzem/Artists-Theme
🌄 A free Jekyll Theme developed by the DevTips Community
frobnitzem/authorship-tests
frobnitzem/CabanaMD
Molecular dynamics proxy application based on Cabana
frobnitzem/cp2k
Quantum chemistry and solid state physics software package
frobnitzem/cpp-documentation-example
An example of setting up Sphinx for C++ and building with CMake and Read the Docs
frobnitzem/FastParticleToolkit
Fast Particle Toolkit: A DSL for 2-Body Computations on Accelerators
frobnitzem/fftw_kernel
Example FFTW Kernel Converted to CUDA
frobnitzem/hello-numerical-world
frobnitzem/hello-numerical-world-sc20
Hands-on exercises for Better Scientific Software tutorial at SC20 (2020-11-10)
frobnitzem/hello-tests
frobnitzem/hypre
Parallel solvers for sparse linear systems featuring multigrid methods.
frobnitzem/lammps
Public development project of the LAMMPS MD software package
frobnitzem/lib0
A template build system for library projects.
frobnitzem/lib_path_design
Design Document Arguing for Static Paths and Full Type Signatures
frobnitzem/Lmod
Lmod: An Environment Module System based on Lua, Reads TCL Modules, Supports a Software Hierarchy
frobnitzem/ptc-catalog
PSIP - Progress Tracking Card (PTC) Catalog
frobnitzem/rand_image
Generate a random 2D image using CPU and GPU methods.
frobnitzem/schnetpack
SchNetPack - Deep Neural Networks for Atomistic Systems
frobnitzem/zguide
Learning and Using ØMQ