Skip to main content
Avatar for leopold.talirz from gravatar.com

Username    leopold.talirz

Date joined   Joined on

26 projects

optimade

Last released on

Tools for implementing and consuming OPTiMaDe APIs.

pgtest

Last released on

Creates a temporary, local PostgreSQL database cluster and server for unittesting, and cleans up after itself

aiida-core

Last released on

lammps-interface

Last released on

Automatic generation of LAMMPS input files for molecular dynamics simulations of MOFs

aiida-lsmo

Last released on

AiiDA workflows for the LSMO laboratory at EPFL

aiida-raspa

Last released on

AiiDA plugin for RASPA code

aiida-export-migration-tests

Last released on

Export archives for migration tests for AiiDA

calc-pe

Last released on

Calculator for the CO2 parasitic energy from CO2 and N2 isotherms

aiida-zeopp

Last released on

AiiDA plugin for zeo++

aiidalab

Last released on

Meta package for the AiiDA lab python environment.

aiidalab-widgets-base

Last released on

aiida-diff

Last released on

AiiDA demo plugin that wraps the `diff` executable for computing the difference between two files.

aiida

Last released on

AiiDA: an automated interactive infrastructure and database for computational science

jsmol-bokeh-extension

Last released on

bokeh extension for jsmol

aiida-ddec

Last released on

AiiDA plugin DDEC code

aiida-cp2k

Last released on

The CP2K plugin for the AiiDA workflow and provenance engine.

cif2cell

Last released on

Construct a unit cell from CIF data

aiida-quantumespresso

Last released on

The official AiiDA plugin for Quantum ESPRESSO

reentry

Last released on

A plugin manager based on setuptools entry points mechanism

appmode-aiidalab

Last released on

A Jupyter extensions that turns notebooks into web applications, with modifications for AiiDA lab.

aiida-qeq

Last released on

AiiDA plugin for computing electronic charges on atoms using equilibration-type models (QEq, EQEq, ...).

idea-code

Last released on

interacting Dynamic Electrons Approach

aiida-widgets

Last released on

AiiDA widgets for the [AiiDA Lab](aiidalab.materialscloud.org).

aiida-phtools

Last released on

AiiDA plugin for persistence homology tools, used to analyze nanoporous materials.

aiida-gudhi

Last released on

AiiDA plugin for the [GUDHI](http://gudhi.gforge.inria.fr/) library for topological data analysis.

aiida-plugin-template

Last released on

AiiDA plugin template for testing and getting started with development

Supported by

Elastic Elastic Search Pingdom Pingdom Monitoring Google Google BigQuery Sentry Sentry Error logging AWS AWS Cloud computing DataDog DataDog Monitoring Fastly Fastly CDN DigiCert DigiCert EV certificate StatusPage StatusPage Status page