benroberts999 / ampsci
A c++ program for high-precision atomic structure calculations of one and two valence systems. Uses Hartree-Fock + correlation potential method. Can calculate ionisation cross sections with large of energy/momentum transfer.
☆20Updated 2 weeks ago
Related projects ⓘ
Alternatives and complementary repositories for ampsci
- Performance portable equations of state and mixed cell closures☆27Updated this week
- ☆32Updated this week
- Finite Element Solvers for Atomic Structure Calculations☆12Updated 10 months ago
- Small Non-Linear Solver☆15Updated last month
- This repository mirrors the principal Gitlab repository of the Chebyshev Accelerated Subspace iteration Eigensolver. If you want to contr…☆15Updated last month
- Fortran Library for numerical INTegration of differential equations☆43Updated 10 months ago
- A collection of fortran modules and routines to support quantum many-body calculations, with a strong focus on Dynamical Mean-Field Theor…☆15Updated 2 weeks ago
- ☆27Updated 3 weeks ago
- C++ library for multi-dimensional arrays☆15Updated this week
- DCA++☆36Updated last week
- A generic implementation of tensor einsum in Fortran.☆25Updated 3 years ago
- Material for text to LNP on Nuclear Physics☆26Updated 4 years ago
- Library for Green’s function based electronic structure theory calculations☆21Updated last week
- Molecular dynamics proxy application based on Cabana☆20Updated last month
- Double precision version of fftpack☆68Updated 3 months ago
- A quantum operator algebra domain-specific language and exact diagonalization toolkit for C++11/14/17☆21Updated this week
- Python wrapper for the Cubature algorithm explained in: http://ab-initio.mit.edu/wiki/index.php/Cubature☆36Updated 8 months ago
- Integration of the Fortran standard library in CMake projects☆13Updated 3 years ago
- Examples of using the object-oriented features in Fortran, taken from my presentation at RSECon 2019☆24Updated 5 years ago
- 3D unaveraged FEL simulation code☆24Updated 2 years ago
- A lightweight, efficient, highly automated, fortran wrapper for python.☆69Updated 6 months ago
- ☆48Updated 2 months ago
- Fortnet is a Behler-Parrinello-Neural-Network implementation, written in modern Fortran.☆29Updated 6 months ago
- A continuous-time hybridization-expansion Monte Carlo code for calculating n-particle Green's functions of the Anderson impurity model an…☆50Updated 2 months ago
- General Relativistic Atomic Structure Package☆57Updated 2 weeks ago
- Scientific Computing Template Library☆19Updated this week
- Isovector nucleon axial coupling☆11Updated 11 months ago
- GPU-Enabled, Zero-Copy AMReX Python Bindings including AI/ML☆36Updated this week
- Simple, parallel, object-oriented Fortran neural network☆20Updated 6 years ago
- Fortran compilers, preprocessors, static analyzers, transpilers, IDEs, build systems, etc.☆54Updated 8 months ago