☆12Apr 17, 2025Updated last year
Alternatives and similar repositories for qscaild
Users that are interested in qscaild are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- ☆13Apr 12, 2023Updated 3 years ago
- The python implementation of the Stochastic Self-Consistent Harmonic Approximation (SSCHA).☆86Oct 5, 2026Updated 3 weeks ago
- bands4vasp -- post processing package for the analysis of unfolded eigenstates in VASP, and much more: band structures, 2D and 3D Fermi s…☆17Aug 31, 2026Updated last month
- EChemDID and various USER packages for LAMMPS.☆11Jan 20, 2023Updated 3 years ago
- Accelerating superconductor discovery through tempered deep learning of the electron-phonon spectral function☆11Aug 20, 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.
- to compute Irreducible Representations by linking the libIRVSP.a to PWscf/QE code and phonon modes. R. Ref: Zhang, et al. Phys. Rev. Res…☆16Jan 6, 2026Updated 9 months ago
- A streamlit web application for running PyFock interactively on the web or your own PC.☆15Sep 15, 2026Updated last month
- ☆23Jun 29, 2026Updated 4 months ago
- BoltzGnu Contains Gnuplot Scripts which allow to plot BoltzTraP Output Data☆17Apr 7, 2020Updated 6 years ago
- An extension module to ShengBTE for computing four-phonon scattering rates and thermal conductivity☆86Oct 16, 2026Updated 2 weeks ago
- Estimate the thermal conductivity using empirical models☆13Mar 19, 2021Updated 5 years ago
- Ground-state solver for a generalized Ising model, based on MAXSAT and convex optimization, following the algorithm described in Huang et…☆15Oct 26, 2016Updated 10 years ago
- A unified package for post-processing optical properties of point defects from first principles calculation.☆12Jul 18, 2026Updated 3 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
- 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.
- A software to calculate thermal conductivity quickly and accurately☆39Feb 20, 2020Updated 6 years ago
- Public releases of the NeuralIL differentiable neural-network force field☆14Sep 10, 2024Updated 2 years ago
- A tool for plotting phonon dispersion curves and phonon density of states.☆12Oct 1, 2020Updated 6 years ago
- ☆10Sep 26, 2025Updated last year
- Magnetic critical temperature Calculator☆18Apr 2, 2024Updated 2 years ago
- The Temperature Dependent Effective Potentials (TDEP) code☆126Oct 7, 2026Updated 3 weeks ago
- Phonon anharmonicity analysis from molecular dynamics☆143Oct 23, 2026Updated last week
- Tutorial files for alamode☆15Aug 6, 2024Updated 2 years ago
- MAISE Module for Ab Initio Structure Evolution (MAISE)☆39May 20, 2026Updated 5 months ago
- 1-Click AI Models by DigitalOcean Gradient • AdDeploy popular AI models on DigitalOcean Gradient GPU virtual machines with just a single click. Zero configuration with optimized deployments.
- AICON2: A program for calculating transport properties quickly and accurately☆16Sep 25, 2023Updated 3 years ago
- L. N. Kantorovich, User-friendly visualisation program for ab initio DFT codes VASP, SIESTA, QE and QUICKSTEP, 1996-2012, unpublished.☆13Apr 24, 2012Updated 14 years ago
- Commands to run VASP jobs automatically. Pre-processing or post-processing☆10Jan 8, 2024Updated 2 years ago
- TDEP Tutorials☆38Jun 1, 2025Updated last year
- Electronic structure code using G0W0 and GW0 calculations for realistic materials☆11Aug 24, 2020Updated 6 years ago
- Finite-size corrections of defect energy levels involving ionic polarization☆11Oct 20, 2022Updated 4 years ago
- Development of DFT-trained machine-learning interatomic potentials for lithium niobate, with applications to large-scale MD simulations i…☆16Jul 23, 2026Updated 3 months ago
- Data-driven risk-conscious thermoelectric materials discovery