QijingZheng / VaspVib2XSFLinks
Visualize vibrational modes from VASP calculations
☆44Updated 10 months ago
Alternatives and similar repositories for VaspVib2XSF
Users that are interested in VaspVib2XSF are comparing it to the libraries listed below
Sorting:
- Tool for plotting modes generated by DFPT calculations (IBRION=7 or 8) in VASP☆34Updated last year
- A collection of tips, scripts, tools, and files to enable a better workflow for phonon calculations using VASP and phonopy.☆34Updated 3 years ago
- A tool for streamlining data analysis and visualisation for thermoelectrics and charge carrier transport in computational materials scien…☆52Updated 6 months ago
- Dealing with slabs for first principles calculations of surfaces☆65Updated 2 years ago
- Export Eigenvectors from Phonopy format to VESTA☆50Updated 11 months ago
- A set of tools for mapping and analysing the potential-energy surfaces along phonon modes.☆47Updated last year
- Python library for point-defect calculations in non-metallic solids based on first-principle calculations with the VASP code.☆63Updated last week
- Tools for Phono(3)py power users.☆34Updated 2 years ago
- A collection of tips, scripts, tools and files to improve your workflow, or simply help you start with ab initio Molecular Dynamics (AIMD…☆26Updated 2 years ago
- Band structure unfolding made easy!☆58Updated last month
- Interfacial Phonon code☆28Updated 3 years ago
- Kubo-Greenwood for transport properties from First Principle Molecular Dynamics with VASP☆26Updated 5 years ago
- VASP Convergence Testing (for Energy & Dielectric Constants)☆56Updated 3 weeks ago
- Occupation matrix control modification VASP☆52Updated 6 years ago
- A simple BASH script for extraction of infared intensities from DFPT calculation output by VASP code.☆26Updated last year
- ☆45Updated 7 years ago
- This API_Phonons is a set of python scripts and functions for interfacing different packages for phonon modeling.☆32Updated last month
- Calculates various definitions of effective mass from the electronic bandstructure of a semiconductor.☆81Updated 6 months ago
- Allen-Feldman thermal conductivity compatible to GULP implementation☆20Updated 8 months ago
- ☆60Updated 3 years ago
- Site-Occupation Disorder☆47Updated 7 months ago
- Scripts for analyzing VASP output and preparing VASP input, especially for NEB calculations.☆20Updated 6 years ago
- To implement the phonon SED (spectral energy desity) method in 2010, phonon lifetime can be calculated.☆47Updated last week
- Automatic search for the most stable magnetic state of a given structure☆24Updated 2 years ago
- A Python suite for manipulating VASP input and output☆48Updated 3 weeks ago
- ASE interface for fully constant potential with VASP☆40Updated last year
- quick analysis of vasp calculation☆38Updated last year
- A code for generating irreducible site-occupancy configurations☆51Updated last year
- The package TransOpt makes it possible for VASP users to calculate electrical transport properties (Seebeck coefficients, electrical cond…☆55Updated 3 years ago
- ☆36Updated 6 years ago