A tool for streamlining data analysis and visualisation for thermoelectrics and charge carrier transport in computational materials science.
☆55May 9, 2025Updated last year
Alternatives and similar repositories for ThermoParser
Users that are interested in ThermoParser are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- ThermoElectric is a computational framework that computes electron transport coefficients.☆24Sep 23, 2024Updated last year
- Calculates various definitions of effective mass from the electronic bandstructure of a semiconductor.☆86May 11, 2026Updated last month
- Electronic transport properties from first-principles calculations☆161May 25, 2026Updated 2 weeks ago
- The package TransOpt makes it possible for VASP users to calculate electrical transport properties (Seebeck coefficients, electrical cond…☆56Jan 26, 2026Updated 4 months ago
- Tools for Phono(3)py power users.☆37Oct 23, 2023Updated 2 years ago
- End-to-end encrypted cloud storage - Proton Drive • AdSpecial offer: 40% Off Yearly / 80% Off First Month. Protect your most important files, photos, and documents from prying eyes.
- Restructure single parabolic band(RSPB) model used for thermoelectricity☆11Jul 25, 2025Updated 10 months ago
- Defect structure-searching employing chemically-guided bond distortions☆125May 11, 2026Updated last month
- doped is a Python software for the generation, pre-/post-processing and analysis of defect supercell calculations, implementing the defec…☆259Updated this week
- DefAP is a program developed to facilitate the exploration of a material's defect chemistry. A large number of features are provided and …☆22Apr 30, 2025Updated last year
- In analogy with thirdorder.py in ShengBTE, Fourthorder.py is developed to calculate fourth-order interatomic force-constants (4th-IFCs). …☆31Nov 14, 2023Updated 2 years ago
- A high-performance framework for solving phonon and electron Boltzmann equations☆124May 23, 2026Updated 2 weeks ago
- Band structure unfolding made easy!☆67Apr 28, 2026Updated last month
- A software to calculate thermal conductivity quickly and accurately☆39Feb 20, 2020Updated 6 years ago
- A tool for plotting phonon dispersion curves and phonon density of states.☆11Oct 1, 2020Updated 5 years ago
- Managed Kubernetes at scale on DigitalOcean • AdDigitalOcean Kubernetes includes the control plane, bandwidth allowance, container registry, automatic updates, and more for free.
- AICON2: A program for calculating transport properties quickly and accurately☆15Sep 25, 2023Updated 2 years ago
- py-sc-fermi is a materials modelling code for calculating self-consistent Fermi energies and defect concentrations under thermodynamic eq…☆33Updated this week
- extract third order force constants from TDEP output☆10Jun 22, 2020Updated 5 years ago
- Heavyweight plotting tools for ab initio calculations☆252Apr 9, 2026Updated 2 months ago
- Dealing with slabs for first principles calculations of surfaces☆70Sep 17, 2023Updated 2 years ago
- Gaussian and Lorentzian smearing of simulated spectra☆44Oct 8, 2024Updated last year
- TDEP Tutorials☆37Jun 1, 2025Updated last year
- A collection of structures, force constants and phonon data obtained from first-principles calculations☆41Sep 13, 2020Updated 5 years ago
- ☆13Nov 16, 2022Updated 3 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.
- An extension module to ShengBTE for computing four-phonon scattering rates and thermal conductivity☆82Apr 20, 2026Updated last month
- Toolkit for visualizing phase stability and defects diagrams from DFT calculations of multicomponent materials.☆19Feb 20, 2024Updated 2 years ago
- A unified package for post-processing optical properties of point defects from first principles calculation.☆11Updated this week
- Band unfolding for phonons☆62Oct 23, 2024Updated last year
- Script to generate distorted perovskite structures☆13Feb 10, 2024Updated 2 years ago
- Python Package to Calculate IR Intensities from the Dipole Approximation with Phonopy and VASP☆31Aug 6, 2021Updated 4 years ago
- This API_Phonons is a set of python scripts and functions for interfacing different packages for phonon modeling.☆38May 19, 2026Updated 3 weeks ago
- A set of tools for mapping and analysing the potential-energy surfaces along phonon modes.☆50May 6, 2024Updated 2 years ago
- Generate isosurface from density data☆14May 21, 2026Updated 3 weeks ago
- End-to-end encrypted cloud storage - Proton Drive • AdSpecial offer: 40% Off Yearly / 80% Off First Month. Protect your most important files, photos, and documents from prying eyes.
- Interfacial Phonon code☆28Jul 31, 2022Updated 3 years ago
- The Temperature Dependent Effective Potentials (TDEP) code☆119Jun 1, 2026Updated last week
- Wavelike and Particlelike Phonon Transport (WPPT) Solver☆29May 13, 2026Updated 3 weeks ago
- Magnetic critical temperature Calculator☆18Apr 2, 2024Updated 2 years ago
- ☆13Jan 4, 2024Updated 2 years ago
- Implementation for computing nonradiative recombination rates in semiconductors☆52Nov 6, 2025Updated 7 months ago
- Effective mass calculation with DFT☆16Jan 20, 2026Updated 4 months ago