Augmented Plane Waves (both APW and LAPW), band structure computation
☆14Dec 31, 2025Updated 9 months ago
Alternatives and similar repositories for APW
Users that are interested in APW are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Quantum Scattering on a Lennard-Jones potential, cross-section computation.☆11Dec 31, 2025Updated 9 months ago
- Korringa-Kohn-Rostoker (multiple scattering theory/Green's function method) band structure calculation☆20Dec 31, 2025Updated 9 months ago
- Solving Poisson equation using a spectral method, also introducing VTK which will probably be used for other projects☆16Dec 31, 2025Updated 9 months ago
- Variational Quantum Monte Carlo for a molecule, using Fokker-Planck/Langevin approach☆15Dec 31, 2025Updated 9 months ago
- Semi-empirical tight-binding computation of the electronic structure of semiconductors☆13Dec 31, 2025Updated 9 months ago
- GPUs on demand by Runpod - Special Offer Available • AdRun AI, ML, and HPC workloads on powerful cloud GPUs—without limits or wasted spend. Deploy GPUs in under a minute and pay by the second.
- Density Functional Theory with plane waves basis, applied on a 'quantum dot'. Volumetric visualization of orbitals with VTK☆25Dec 31, 2025Updated 9 months ago
- A simple Density Matrix Renormalization Group program☆16Jul 27, 2026Updated 2 months ago
- Density Functional Theory in real space, for atoms, LDA and LSDA☆31Dec 31, 2025Updated 9 months ago
- 2D Fourier Transform of Nuclear Magnetic Resonance Imaging raw data, 3D visualization with VTK☆20Dec 30, 2025Updated 9 months ago
- An open-source C++ software for efficient nanoscale quantum transport simulations☆10Sep 21, 2019Updated 7 years ago
- Electric field lines and equipotentials using Runge-Kutta methods, including adaptive ones☆27Dec 29, 2025Updated 9 months ago
- A simple program implementing the numerical renormalization group☆23Dec 29, 2025Updated 9 months ago
- Competitive Lotka–Volterra equations, solved using Runge-Kutta methods. Four dimensional system.☆12Dec 31, 2025Updated 9 months ago
- A program implementing Metropolis Monte Carlo for the 2D square-lattice Ising model and the spin block renormalization☆32Dec 29, 2025Updated 9 months ago
- Managed hosting for WordPress and PHP on Cloudways • AdManaged hosting for WordPress, Magento, Laravel, or PHP apps, on multiple cloud providers. Deploy in minutes on Cloudways by DigitalOcean.
- A program implementing the Hartree–Fock (also post-HF: MP2, CCSD(T), CIS and TDHF/RPA)/self-consistent field method (also DIIS) with Gaus…☆68Sep 9, 2026Updated last month
- A program implementing event driven molecular dynamics for hard smooth spheres, using OpenGL for displaying☆24Dec 29, 2025Updated 9 months ago
- A 2D Lattice Boltzmann program☆55Dec 30, 2025Updated 9 months ago
- ☆12Oct 9, 2019Updated 7 years ago
- A solar system simulator with Verlet, using OpenGL for displaying.☆67Dec 29, 2025Updated 9 months ago
- Calculating electron-phonon couplings with DFTB.☆12Updated this week
- The link to the website is at☆15Aug 12, 2015Updated 11 years ago
- ☆14Jan 14, 2020Updated 6 years ago
- End-to-end code for predicting Curie temp. and other magnetic properties of 2D materials.☆15Aug 31, 2022Updated 4 years ago
- Managed hosting for WordPress and PHP on Cloudways • AdManaged hosting for WordPress, Magento, Laravel, or PHP apps, on multiple cloud providers. Deploy in minutes on Cloudways by DigitalOcean.
- ☆27Jul 15, 2026Updated 3 months ago
- The Orthogonalized Linear Combination of Atomic Orbitals package.☆27May 8, 2026Updated 5 months ago
- Simple Hartree-Fock codes in Python, C++, fortran☆15Mar 3, 2018Updated 8 years ago
- A code to simulate linearized phonon transport☆15May 7, 2017Updated 9 years ago
- Density matrix embedding theory for periodic systems☆19Dec 3, 2021Updated 4 years ago
- This is a GPU optimized version of ShengBTE.☆20Oct 3, 2024Updated 2 years ago
- Some python workbooks with various topics from Computational Physics☆67Mar 7, 2023Updated 3 years ago
- 李群与李代数课程讨论☆16May 25, 2020Updated 6 years ago
- Precise and fast Fermi-Dirac integrals of integer and half integer order.☆24Jul 12, 2019Updated 7 years ago
- Wordpress hosting with auto-scaling - Free Trial Offer • AdFully Managed hosting for WordPress and WooCommerce businesses that need reliable, auto-scalable performance. Cloudways SafeUpdates now available.
- ☆12Aug 19, 2020Updated 6 years ago
- A python package of utils for DFT, Tight binding, etc.☆16Nov 21, 2025Updated 10 months ago
- Nuclear many-body course for 2018☆20Aug 5, 2022Updated 4 years ago
- Quantum-enhanced GPT-2☆15Mar 19, 2024Updated 2 years ago
- ☆20Oct 18, 2022Updated 4 years ago
- Tutorial files for alamode☆15Aug 6, 2024Updated 2 years ago
- A user package of LAMMPS software enabling simulations using linearized machine learning potentials☆11Jul 2, 2026Updated 3 months ago