Optimized Norm-Conserving Vanderbilt Pseudopotential for Quantum Espresso in UPF format
☆14Dec 15, 2025Updated 3 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:
- Modified EPW code for first principles calculation of electron transport and thermoelectric property of materials, including electron-pho…☆28Sep 14, 2020Updated 5 years ago
- scripts related to qe☆28Jan 14, 2022Updated 4 years ago
- Python scripts to manage and postprocess quantum espresso and yambo calculation.☆19Mar 23, 2026Updated last week
- Optimized Norm-Conserving Vanderbilt Pseudopotential for Quantum Espresso in UPF format☆90Jan 21, 2020Updated 6 years ago
- band unfolding using quantum espresso☆12Jul 7, 2023Updated 2 years ago
- NordVPN Special Discount Offer • AdSave on top-rated NordVPN 1 or 2-year plans with secure browsing, privacy protection, and support for for all major platforms.
- ☆11Nov 3, 2019Updated 6 years ago
- Electron Transport (ELECTRA), open source code from the "GENESIS" project☆12Dec 3, 2025Updated 3 months ago
- TDEP Tutorials☆35Jun 1, 2025Updated 9 months ago
- A VASP and Wannier90 interfaced tool for projection analysis and fully automated dis energy window optimization☆45Aug 24, 2024Updated last year
- Plane wave density functional theory using Julia programming language☆122Mar 22, 2026Updated last week
- Python modules for electron–phonon models☆38Updated this week
- A open-source program for computing the first-order resonance Raman spectroscopy based on Quantum ESPRESSO☆18Feb 23, 2026Updated last month
- Script library mainly about chemical physics.☆26Jun 15, 2025Updated 9 months ago
- BoltzTraP_Tools is an interface written using Python 2 language. It allows to parse and plot BoltzTraP output DATA☆18Mar 7, 2021Updated 5 years ago
- Proton VPN Special Offer - Get 70% off • AdSpecial partner offer. Trusted by over 100 million users worldwide. Tested, Approved and Recommended by Experts.
- Code to convert DFPT modes in OUTCAR files to VESTA images☆26Aug 14, 2022Updated 3 years ago
- Python version ofthe BandUP code☆28Oct 14, 2024Updated last year
- 2017-09-26 Linux source copied from Sourceforge. This is **not** the development repository.☆21Dec 28, 2021Updated 4 years ago
- Collection of ONCVPSP pseudopotentials for density-functional theory calculations☆18Sep 6, 2021Updated 4 years ago
- A code to compute the radial distribution function☆21Feb 22, 2019Updated 7 years ago
- VASP - Localized Orbital Locator + Electron Localizability Indicator☆18Dec 18, 2022Updated 3 years ago
- Export Eigenvectors from Phonopy format to VESTA☆52Dec 24, 2024Updated last year
- Wannier-orbital Basis Suite Towards Electronic-Structure Reconstruction☆15Sep 5, 2023Updated 2 years ago
- A modern DFT + DMFT computation framework☆16Oct 2, 2025Updated 5 months ago
- Wordpress hosting with auto-scaling on Cloudways • AdFully Managed hosting built for WordPress-powered businesses that need reliable, auto-scalable hosting. Cloudways SafeUpdates now available.
- ☆17Oct 21, 2021Updated 4 years ago
- Band structure unfolding made easy!☆61Mar 1, 2026Updated 3 weeks ago
- Creating elastic structures using LAMMPS☆12Jan 30, 2023Updated 3 years ago
- Point symmetry analysis tool for theoretical chemistry objects☆21Dec 2, 2025Updated 3 months ago
- Curatable database for experimental and theoretical data on solid materials.☆13Sep 21, 2025Updated 6 months ago
- A simulation engine for compartmental models☆14Jan 28, 2026Updated 2 months ago
- LaTeX/Tikz package. It provides several commands in order to draw atomic orbitals and molecular orbitals diagrams.☆15Nov 24, 2015Updated 10 years ago
- Semi-empirical tight-binding computation of the electronic structure of semiconductors☆13Dec 31, 2025Updated 2 months ago
- pymatgen-analysis-alloys is an add-on package for pymatgen intended to contain useful classes for describing alloy systems and analyzing …☆16Oct 31, 2025Updated 4 months ago
- Managed hosting for WordPress and PHP on Cloudways • AdManaged hosting with the flexibility to host WordPress, Magento, Laravel, or PHP apps, on multiple cloud providers. Cloudways by DigitalOcean.
- Natural Bond Orbital algorithm to handle systems characterized by periodic symmetry☆21Dec 5, 2021Updated 4 years ago
- efficient TDDFT-ris based on MOKIT and PySCF☆20Jan 18, 2026Updated 2 months ago
- Materials Science Scripts☆13Aug 28, 2025Updated 7 months ago
- ☆11Nov 10, 2020Updated 5 years ago
- Package for investigation of mulitlayer 2D heterostructures' lattices (Work in progress!)☆22Jan 17, 2021Updated 5 years ago
- Tutorial for Wannier2022☆16Feb 22, 2026Updated last month
- ☆40Feb 4, 2026Updated last month