Builds 2D heterostructures via coincidence lattice theory.
☆15Nov 21, 2023Updated 2 years ago
Alternatives and similar repositories for hetbuilder
Users that are interested in hetbuilder are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Automate the discovery of stable 2D materials stacked on substrates (either another 2d or substrate surface)! Compute the properties of t…☆13Apr 2, 2026Updated last month
- Personal collection of scripts to handle FHI-aims calculations.☆11May 26, 2024Updated last year
- V2DB (Virtual 2D Materials Database): the code for generating and predicting the novel 2D materials by virtual screening.☆25Aug 20, 2020Updated 5 years ago
- A phonon irreducible representations calculator☆23Apr 11, 2024Updated 2 years ago
- Code to convert DFPT modes in OUTCAR files to VESTA images☆27Aug 14, 2022Updated 3 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.
- High-Throughput Computational Physics Framework☆13Oct 25, 2017Updated 8 years ago
- Python package that enables high throughput analysis of interfaces(two dimensional materials, hetero-structures, nanoparticles with and w…☆76Feb 3, 2024Updated 2 years ago
- Julia codes to play with Phonons☆24Nov 7, 2018Updated 7 years ago
- Package for investigation of mulitlayer 2D heterostructures' lattices (Work in progress!)☆22Jan 17, 2021Updated 5 years ago
- Python package to analyse electron density & electrostatic potential grids☆90Jan 10, 2026Updated 3 months ago
- Band unfolding for phonons☆62Oct 23, 2024Updated last year
- 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
- MaterialsCoord: infrastructure to benchmark crystal structure coordination algorithms☆20Mar 13, 2023Updated 3 years ago
- A mirror of https://gitlab.kwant-project.org/qt/qsymm☆40Mar 20, 2026Updated last month
- 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.
- quick analysis of vasp calculation☆38Jun 7, 2024Updated last year
- A Python suite for manipulating VASP input and output☆51Mar 28, 2026Updated last month
- Restructure single parabolic band(RSPB) model used for thermoelectricity☆10Jul 25, 2025Updated 9 months ago
- Code for the Selected Columns of the Density Matrix suite of algorithms☆14Dec 7, 2018Updated 7 years ago
- First-principles calculated elastic and mechanical properties of 2D materials and their heterostructures☆16Mar 5, 2024Updated 2 years ago
- Fix lattice component(s) during relaxation in VASP☆141Nov 27, 2025Updated 5 months ago
- Introduction to classical Monte Carlo methods☆26Dec 3, 2021Updated 4 years ago
- STM-2DScan.py is a postprocessing script for VASP code to generate STM images based on DFT-calculations. It firstly imports volumetric d…☆15Mar 30, 2020Updated 6 years ago
- VASP Convergence Testing (for Energy & Dielectric Constants)☆57Nov 11, 2025Updated 5 months 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.
- API database tools for accessing the NIST Interatomic Potentials Repository: explore and download interatomic potentials and computed pro…☆14Aug 14, 2025Updated 8 months ago
- Sky-MoCa Skyrmion - Monte Carlo: Simulated annealing for a 3D spin lattice in Julia☆14Jul 4, 2019Updated 6 years ago
- Automatic search for the most stable magnetic state of a given structure☆25Feb 17, 2026Updated 2 months ago
- A software to calculate thermal conductivity quickly and accurately☆38Feb 20, 2020Updated 6 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…☆28May 25, 2023Updated 2 years ago
- Fermi surface generation, analysis and visualisation.☆101Apr 2, 2026Updated last month
- Parallel Lammps Python interface - control a mpi4py parallel LAMMPS instance from a serial python process or a Jupyter notebook - based o…☆36Apr 27, 2026Updated last week
- A python package to compute zero-field-splitting tensors for molecules and spin quantum bits in semiconductors.☆14Mar 30, 2020Updated 6 years ago
- Calculate 3rd order elastic constant.☆13Mar 23, 2025Updated last year
- 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.
- Quantum Visualization Interacting Toolkit for Ab-initio Simulations☆76Apr 23, 2026Updated last week
- Wannier-orbital Basis Suite Towards Electronic-Structure Reconstruction☆15Sep 5, 2023Updated 2 years ago
- Some ongoing projects in Zhu's group☆28Mar 31, 2024Updated 2 years ago
- Calculates the pair distribution function (PDF) of a POSCAR file.☆12Mar 7, 2016Updated 10 years ago
- Dealing with slabs for first principles calculations of surfaces