Pinned Repositories
Einsums
Provides compile-time contraction pattern analysis to determine optimal tensor operation to perform.
3Dmol.js
WebGL accelerated JavaScript molecular graphics library
ambit
C++ library for the implementation of tensor product calculations through a clean, concise user interface.
aquarius
AQUARIUS (Advanced QUAntum moleculaR Iterative eqUation Solver) is a parallel quantum chemistry package built on the Cyclops Tensor Framework which provides high-performance structured tensor operations. AQUARIUS is primarily focused on iterative methods such as CC, CI, and EOMCC.
blis
BLAS-like Library Instantiation Software Framework
CheMPS2
CheMPS2: a spin-adapted implementation of DMRG for ab initio quantum chemistry
conda-forge-pinning-feedstock
A conda-smithy repository for conda-forge-pinning.
CppCodeTemplate
levmar
Levenberg-Marquardt nonlinear least squares algorithms in C/C++
jturney's Repositories
jturney/levmar
Levenberg-Marquardt nonlinear least squares algorithms in C/C++
jturney/ambit
C++ library for the implementation of tensor product calculations through a clean, concise user interface.
jturney/Einsums
Provides compile-time contraction pattern analysis to determine optimal tensor operation to perform.
jturney/3Dmol.js
WebGL accelerated JavaScript molecular graphics library
jturney/blis
BLAS-like Library Instantiation Software Framework
jturney/conda-forge-pinning-feedstock
A conda-smithy repository for conda-forge-pinning.
jturney/CppCodeTemplate
jturney/Fermi.jl
Fermi quantum chemistry program
jturney/einsums-feedstock
A conda-smithy repository for einsums.
jturney/h5cpp
C++17 templates between [stl::vector | armadillo | eigen3 | ublas | blitz++] and HDF5 datasets
jturney/homebrew-packages
jturney/hptt
High-Performance Tensor Transpose library
jturney/ittapi
Intel® Instrumentation and Tracing Technology (ITT) and Just-In-Time (JIT) API
jturney/libcint
general GTO integrals for quantum chemistry
jturney/libcxxwrap-julia
C++ library for backing CxxWrap.jl
jturney/limine
x86/x86_64 BIOS/UEFI Bootloader
jturney/Lints
Libint2 interface to Julia
jturney/oneMKL
oneAPI Math Kernel Library (oneMKL) Interfaces
jturney/psi4
Open-Source Quantum Chemistry – an electronic structure package in C++ driven by Python
jturney/psi4numpy
Combining Psi4 and Numpy for education and development.
jturney/psicode-hugo-website
Psi4 user website psicode.org (was https://admiring-tesla-08529a.netlify.com/)
jturney/pybind11
Seamless operability between C++11 and Python
jturney/qcdb
quantum chemistry common driver and databases
jturney/QCEngine
A wrapper for Quantum Chemistry engines that adheres to the MolSSI QCSchema.
jturney/scipy
Scipy library main repository
jturney/sympy
A computer algebra system written in pure Python
jturney/tblis
TBLIS is a library and framework for performing tensor operations, especially tensor contraction, using efficient native algorithms.
jturney/TBLIS.jl
Julia wrapper for TBLIS tensor contraction library.
jturney/TensorLet_in_C_C_PlusPlus
J. Huang, L. Kong, X.-Y. Liu, W. Qu and G. Chen. A C++ library for tensor decomposition. International Performance Computing and Communications Conference (IPCCC), 2019. A C/C++ library for highly efficient and scalable tensor decompositions.
jturney/vcpkg
C++ Library Manager for Windows, Linux, and MacOS