Optimized Norm-Conserving Vanderbilt Pseudopotential for Quantum Espresso in UPF format
☆15Dec 15, 2025Updated 10 months ago
Alternatives and similar repositories for ONCVPSP_LDA
Users that are interested in ONCVPSP_LDA are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- ☆14Jun 18, 2026Updated 4 months ago
- Modified EPW code for first principles calculation of electron transport and thermoelectric property of materials, including electron-pho…☆30Sep 14, 2020Updated 6 years ago
- Optimized Norm-Conserving Vanderbilt Pseudopotential for Quantum Espresso in UPF format☆96Jan 21, 2020Updated 6 years ago
- Python scripts to manage and postprocess quantum espresso and yambo calculation.☆22Oct 13, 2026Updated 3 weeks ago
- scripts related to qe☆28Jan 14, 2022Updated 4 years ago
- Deploy on Railway without the complexity - Free Credits Offer • AdConnect your repo and Railway handles the rest with instant previews. Quickly provision container image services, databases, and storage volumes.
- ☆16Jun 13, 2023Updated 3 years ago
- Collection of ONCVPSP pseudopotentials for density-functional theory calculations☆21Sep 6, 2021Updated 5 years ago
- band unfolding using quantum espresso☆13Jul 7, 2023Updated 3 years ago
- ☆12Nov 3, 2019Updated 7 years ago
- Export Eigenvectors from Phonopy format to VESTA☆57Dec 24, 2024Updated last year
- Electron Transport (ELECTRA), open source code from the "GENESIS" project☆13Dec 3, 2025Updated 11 months ago
- Harmonic phonon transmission calculations from molecular dynamics trajectories☆14Nov 11, 2019Updated 6 years ago
- Take electron-phonon interaction as non-adiabatic coupling to do non-adiabatic molecular dynamics simulation.☆11Jun 27, 2024Updated 2 years ago
- A phonon irreducible representations calculator☆24Apr 11, 2024Updated 2 years ago
- Deploy to Railway using AI coding agents - Free Credits Offer • AdUse Claude Code, Codex, OpenCode, and more. Autonomous software development now has the infrastructure to match with Railway.
- A code to compute the radial distribution function☆21Feb 22, 2019Updated 7 years ago
- A python utilities to handle with atomic structures and interfacing with common formats (xyz and quantum-espresso).☆28Jul 22, 2026Updated 3 months ago
- ☆12Oct 3, 2026Updated last month
- Automation software for calculating anharmonic phonon properties☆31Oct 29, 2026Updated last week
- Plane wave density functional theory using Julia programming language☆122Oct 4, 2026Updated last month
- Python modules for electron–phonon models☆41Sep 16, 2026Updated last month
- Script library mainly about chemical physics.☆26Jun 15, 2025Updated last year
- BoltzTraP_Tools is an interface written using Python 2 language. It allows to parse and plot BoltzTraP output DATA☆19Mar 7, 2021Updated 5 years ago
- A VASP and Wannier90 interfaced tool for projection analysis and fully automated dis energy window optimization☆48Aug 24, 2024Updated 2 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.
- VASP - Localized Orbital Locator + Electron Localizability Indicator☆19Dec 18, 2022Updated 3 years ago
- Code to convert DFPT modes in OUTCAR files to VESTA images☆27Aug 14, 2022Updated 4 years ago
- TDEP Tutorials☆38Jun 1, 2025Updated last year
- Wannier-orbital Basis Suite Towards Electronic-Structure Reconstruction☆16Sep 5, 2023Updated 3 years ago
- ☆17Oct 21, 2021Updated 5 years ago
- Python Package for Band Unfolding of Plane-wave Based First-Principles Calculations☆29Jul 27, 2026Updated 3 months ago
- This repository contains example codes for the book: Quantum ESPRESSO Course for Solid‑State Physics, Jenny Stanford Publishing, New York…☆98Jul 7, 2026Updated 4 months ago
- Tutorial for Wannier2022☆17Oct 16, 2026Updated 3 weeks ago
- Point symmetry analysis tool for theoretical chemistry objects☆22Aug 4, 2026Updated 3 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.
- LAMMPS extension to capture electron-ion interaction. This is a mirror of https://gitlab.com/artuuuro/USER-EPH.☆23Oct 8, 2026Updated last month
- Solving for 1-d GaAs quantum well using finite differences to solve Schrodinger's and Poisson's equation in MATLAB☆10Sep 4, 2015Updated 11 years ago
- Package for investigation of mulitlayer 2D heterostructures' lattices (Work in progress!)☆22Jan 17, 2021Updated 5 years ago
- Natural Bond Orbital algorithm to handle systems characterized by periodic symmetry☆21Dec 5, 2021Updated 4 years ago
- Creating elastic structures using LAMMPS☆11Jan 30, 2023Updated 3 years ago
- Analysis of quantum chemical interactions in molecules and solids.☆127Updated this week
- Calculate parity of a k point using WAVECAR☆11Oct 10, 2019Updated 7 years ago