mcsorkun / V2DBLinks
V2DB (Virtual 2D Materials Database): the code for generating and predicting the novel 2D materials by virtual screening.
☆24Updated 5 years ago
Alternatives and similar repositories for V2DB
Users that are interested in V2DB are comparing it to the libraries listed below
Sorting:
- ☆18Updated 6 years ago
- Implementation for computing nonradiative recombination rates in semiconductors☆49Updated 3 months ago
- Effective Mass Calculator for Semiconductors☆110Updated 5 years ago
- Calculates various definitions of effective mass from the electronic bandstructure of a semiconductor.☆83Updated 8 months ago
- Band structure unfolding made easy!☆60Updated last month
- Defect structure-searching employing chemically-guided bond distortions☆112Updated last week
- Electronic transport properties from first-principles calculations☆158Updated last week
- Python library for point-defect calculations in non-metallic solids based on first-principle calculations with the VASP code.☆65Updated 2 months ago
- MPmorph is a collection of tools to run and analyze ab-initio molecular dynamics (AIMD) calculations run with VASP, and is currently unde…☆73Updated last year
- A tool for streamlining data analysis and visualisation for thermoelectrics and charge carrier transport in computational materials scien…☆52Updated 9 months ago
- VASP Convergence Testing (for Energy & Dielectric Constants)☆56Updated 2 months ago
- ☆62Updated 3 years ago
- a python package for computing magnetic interaction parameters☆91Updated last week
- Band unfolding for phonons☆58Updated last year
- ☆69Updated 2 years ago
- The package TransOpt makes it possible for VASP users to calculate electrical transport properties (Seebeck coefficients, electrical cond…☆55Updated 2 weeks ago
- Python interface for VASP☆89Updated this week
- BandUP: Band Unfolding code for Plane-wave based calculations☆107Updated 4 years ago
- A computational framework to automate point defect calculations☆38Updated 7 years ago
- Modeling and Crystallographic Utilities☆52Updated 2 years ago
- Thermo_pw is a driver of quantum-ESPRESSO routines for the automatic computation of ab-initio material properties.☆59Updated 3 weeks ago
- ☆42Updated last year
- A user friendly tools using Monte Carlo simulations for estimation of Curie temperature☆90Updated 10 months ago
- An extension module to ShengBTE for computing four-phonon scattering rates and thermal conductivity☆75Updated 2 months ago
- Visualise lattice vibrations☆107Updated 8 months ago
- Blender extensions for illustrations of phonons☆67Updated 6 years ago
- A grain boundary generation code☆80Updated 2 years ago
- quick analysis of vasp calculation☆38Updated last year
- The python implementation of the Stochastic Self-Consistent Harmonic Approximation (SSCHA).☆71Updated 3 months ago
- Fermi surface generation, analysis and visualisation.☆98Updated last week