35 results for “topic:siesta”
Atomsk: A Tool For Manipulating And Converting Atomic Data Files -
Electronic structure Python package for post analysis and large scale tight-binding DFT/NEGF calculations
a python package for computing magnetic interaction parameters
Python package for eigenchannels, vibrations and inelastic electron transport based on SIESTA/TranSIESTA DFT
Implementation of a machine learned density functional
FDF files for relaxation, PDOS and Denchar calculations in SIESTA 4.0.2 version as well as 4.1v and PSML supported version
Molecular dynamics package designed for the SIESTA DFT code.
A family tree API server implementation with iOS client. Server has been implemented with Perfect: Server-Side Swift And iOS client is in pure Swift.
Automated DFT Input File Generator using wxDragon
Interfaces for atomistic simulation codes and workflows
Tutorials for the SOMD code.
Interfacing SIESTA to Lua scripts using the flook code
Simple Python Ipywidgets Interface to obtain the optoelectronic properties of Nanostructures
Use the latest stable release of Siesta and github action perform to small DFT calculations.
Python bindings for "Siesta as a subroutine" DFT
Siesta, transiesta, tbtrans...... without touching the terminal
Simple iOS reader for New York Times.
Rey Wenderlich's iOS application tutorial for implementing RESTful Client w/ Siesta
This is repository of Jan Sorna for all workshop exercises (Ferrilata, Siesta, Prague)
Dalibor Drozda- Ferrilata siesta
Alzbeta Sipkova's repository
MATLAB toolbox to read Siesta, a Density Functional Theory (DFT) calculation platform, generated files.
Lukas Krocek
Python package calculating relativistic magnetic interactions for the generalised Heisenberg model.
Sample Repository showing how the Github-action [siesta-action](https://github.com/marketplace/actions/siesta-action) can be used.
Natálie Heniková
Visualizador de bandas eletrônicas com interface gráfica em Python
SIESTAstepper runs SIESTA step by step, designed for constrained calculations.
Stanislav Koumar, Ferrilata Siesta Prague
No description provided.