milthorpe / spherical-harmonics
C++ code to compute normalized associated Legendre polynomials and spherical harmonics
☆16Updated 8 years ago
Related projects ⓘ
Alternatives and complementary repositories for spherical-harmonics
- Automatic code generation of Fast Multipole and Barnes-Hut operators☆18Updated 2 years ago
- Code generator for simint vectorized integrals☆28Updated last year
- Exchange correlation (XC) library for density functional theory (DFT) calculations in modern C++☆18Updated 3 months ago
- MultiResolution Chemistry☆30Updated 2 weeks ago
- Molecular dynamics proxy application based on Cabana☆20Updated last month
- A CUDA project for Molecular Dynamics, Brownian Dynamics, Hydrodynamics... intended to simulate a very generic system constructing a simu…☆52Updated last week
- MGmol is a scalable O(N) First-Principles Molecular Dynamics code that is capable of performing large-scale electronics structure calcula…☆44Updated this week
- An open source toolkit for simulating RIXS spectra based on ED☆34Updated 2 months ago
- Performance portable equations of state and mixed cell closures☆27Updated this week
- Simple, parallel, object-oriented Fortran neural network☆20Updated 6 years ago
- A C++ library to compute the Wigner 3j- and 6j- symbols (with FORTRAN backend).☆30Updated 6 months ago
- Library for Green’s function based electronic structure theory calculations☆21Updated 2 weeks ago
- A generic implementation of tensor einsum in Fortran.☆25Updated 3 years ago
- Clair (Clang Introspection and Reflection) tools. A set of clang tools developed for Flatiron/CCQ☆11Updated last week
- XCFun: A library of exchange-correlation functionals with arbitrary-order derivatives☆58Updated last year
- Fortnet is a Behler-Parrinello-Neural-Network implementation, written in modern Fortran.☆29Updated 6 months ago
- Scientific Computing Template Library☆19Updated this week
- A modern C++ library for high-performance configuration interaction methods☆15Updated 3 weeks ago
- Calculation of Wigner symbols and related constants☆10Updated last year
- Positively Split Ewald☆20Updated 3 years ago
- GW-BSE for excited state Quantum Chemistry in a Gaussian Orbital basis, electronic spectroscopy with QM/MM, charge and energy dynamics in…☆29Updated 3 years ago
- ☆17Updated 2 weeks ago
- Autopas is a node-level auto-tuned particle simulation library developed in the context of the TaLPas project.☆35Updated this week
- GPU-accelerated Quantum ESPRESSO using CUDA FORTRAN☆59Updated 4 years ago
- Topological Analysis for Molecular Systems☆17Updated 5 years ago
- GauXC is a modern, modular C++ library for the evaluation of quantities related to the exchange-correlation (XC) energy (e.g. potential, …☆27Updated 2 months ago
- GPU-Enabled, Zero-Copy AMReX Python Bindings including AI/ML☆36Updated this week
- Finite element methods for electronic structure calculations on small systems☆34Updated 3 weeks ago
- MultiResolution Computation Program Package☆12Updated last month
- Routines for Radial Integration of Dirac, Schrödinger, and Poisson Equations☆74Updated last week