Phonon anharmonicity analysis from molecular dynamics
☆143Jul 22, 2026Updated 3 weeks ago
Alternatives and similar repositories for DynaPhoPy
Users that are interested in DynaPhoPy are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- LAMMPS interface for phonon calculations using phonopy☆96Nov 5, 2025Updated 9 months ago
- Ab initio simulator for thermal transport and lattice anharmonicity☆201Jul 29, 2026Updated 2 weeks ago
- Blender extensions for illustrations of phonons☆69Mar 6, 2019Updated 7 years ago
- Band unfolding for phonons☆63Oct 23, 2024Updated last year
- A simulation package of phonon-phonon interaction related properties☆165Updated this week
- 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.
- Tools for Phono(3)py power users.☆37Oct 23, 2023Updated 2 years ago
- A collection of tips, scripts, tools, and files to enable a better workflow for phonon calculations using VASP and phonopy.☆35Aug 19, 2022Updated 3 years ago
- The Temperature Dependent Effective Potentials (TDEP) code☆122Jul 2, 2026Updated last month
- A collection of tools for simulating vibrational spectra, which interfaces with the Phonopy package.☆192Jul 2, 2026Updated last month
- Anharmonic Lattice Dynamics☆190Updated this week
- Phonon code☆488Updated this week
- A set of tools for mapping and analysing the potential-energy surfaces along phonon modes.☆51May 6, 2024Updated 2 years ago
- TDEP Tutorials☆38Jun 1, 2025Updated last year
- A code to estimate transport coefficients from the cepstral analysis of a (multi)variate current stationary time series -- [FKA "thermoce…☆46Sep 4, 2025Updated 11 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.
- Python tools for calculating the spectral heat current distribution from LAMMPS NEMD simulations☆32Dec 25, 2021Updated 4 years ago
- Compressive sensing lattice dynamics☆31May 7, 2026Updated 3 months ago
- Calculation of phonon participation rates - used to characterize atomic vibrational information including the degree of localization and …☆27Dec 17, 2025Updated 7 months ago
- The documentation site for TDEP.☆28Aug 17, 2023Updated 2 years ago
- Band structure unfolding made easy!☆67Jul 6, 2026Updated last month
- GPUMD and LAMMPS helper functions for thermal computations☆10May 21, 2022Updated 4 years ago
- potfit force-matching code☆43May 20, 2026Updated 2 months ago
- Visualise lattice vibrations☆112Apr 4, 2026Updated 4 months ago
- An extension module to ShengBTE for computing four-phonon scattering rates and thermal conductivity☆84Apr 20, 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.
- A collection of structures, force constants and phonon data obtained from first-principles calculations☆41Sep 13, 2020Updated 5 years ago
- A 200-line Matlab implementation of the Atomistic Green's function (AGF) method for phonon transport☆30Feb 8, 2020Updated 6 years ago
- ☆22Jun 29, 2026Updated last month
- Calculates various definitions of effective mass from the electronic bandstructure of a semiconductor.☆86May 11, 2026Updated 3 months ago
- This API_Phonons is a set of python scripts and functions for interfacing different packages for phonon modeling.☆39May 19, 2026Updated 2 months ago
- ☆13Apr 12, 2023Updated 3 years ago
- ☆23Jun 2, 2024Updated 2 years ago
- Tools for computing spectral heat current distribution using LAMMPS NEMD simulations.☆15Mar 11, 2020Updated 6 years ago
- Harmonic phonon transmission calculations from molecular dynamics trajectories☆14Nov 11, 2019Updated 6 years ago
- GPU virtual machines on DigitalOcean Gradient AI • AdGet to production fast with high-performance AMD and NVIDIA GPUs you can spin up in seconds. The definition of operational simplicity.
- python code to calculate inelastic-neutron-scattering dynamic structure factor, S(Q,w), from molecular dynamics trajectories using parall…☆23May 7, 2026Updated 3 months ago
- The official AiiDA plugin for Phonopy☆23Jul 21, 2026Updated 3 weeks ago
- The package TransOpt makes it possible for VASP users to calculate electrical transport properties (Seebeck coefficients, electrical cond…☆56Jan 26, 2026Updated 6 months ago
- A software to calculate thermal conductivity quickly and accurately☆39Feb 20, 2020Updated 6 years ago
- Electronic transport properties from first-principles calculations☆163Updated this week
- (NEW) Tools for computing spectral heat current distribution using LAMMPS NEMD simulations.☆35Dec 13, 2024Updated last year
- To implement the phonon SED (spectral energy desity) method in 2010, phonon lifetime can be calculated.☆58Updated this week