Pinned Repositories
aiidalab-qe
AiiDAlab App for Quantum ESPRESSO
aiida-workgraph
Efficiently design and manage flexible workflows with AiiDA, featuring an interactive GUI, checkpoints, provenance tracking, and remote execution capabilities.
beautiful-atoms
Python module for drawing and rendering beautiful atoms and molecules using Blender.
blase
Python module for drawing and rendering ASE (Atomic Simulation Environment) atoms and molecules objects using blender.
pyliterature
A Pythonic wrapper for the scientific journal, including Nature, Science, ScienceDirect, Wiley, ACS publication, RSC publication and so on.
weas
WEAS is JavaScript library to visualize and manipulate the atomic structures directly in the web browser.
weas-widget
A widget to visualize and edit atomic structures in Jupyter Notebook
x3dase
X3D for Atomic Simulation Environment
xcp2k
xcp2k is an module to combine CP2K into Atomic Simulation Environment (ASE)
xespresso
Quantum ESPRESSO Calculator for Atomic Simulation Environment (ASE).
superstar54's Repositories
superstar54/blase
Python module for drawing and rendering ASE (Atomic Simulation Environment) atoms and molecules objects using blender.
superstar54/xespresso
Quantum ESPRESSO Calculator for Atomic Simulation Environment (ASE).
superstar54/x3dase
X3D for Atomic Simulation Environment
superstar54/xcp2k
xcp2k is an module to combine CP2K into Atomic Simulation Environment (ASE)
superstar54/PyXPS
Python code to analyze x-ray phonons spectroscopy (XPS) by deep learning (DL), including convolutional neural network (CNN) methods.
superstar54/beautiful-atoms
Python module for drawing and rendering beautiful atoms and molecules using Blender.
superstar54/aiida-code-registry
Registry of simulation codes and computers for easy setup in AiiDA.
superstar54/aiida-qe-tools
Script to for aiida-qe
superstar54/aiida-registry
Find plugins for AiiDA
superstar54/aiida-restapi
AiiDA Web API for data queries and workflow management.
superstar54/aiida-tutorials
AiiDA tutorials web site
superstar54/aiida-wannier90-workflows
A collection of advanced automated workflows to compute Wannier functions using AiiDA and the Wannier90 code
superstar54/aiidalab-qe-eos
A aiidalab-qe plugin to calculate the equation of state of a crystal.
superstar54/aiidalab-qe-hello-world
Simplest possible AiiDAlab-QE plugin
superstar54/aiidalab-qe-multiply-add
superstar54/aiidalab-restapi
AiiDA REST API for AiiDAlab
superstar54/bsc-2021-unibe
BSc Project Ammonolysis
superstar54/CAD_Sketcher
Constraint-based geometry sketcher for blender
superstar54/Coursera-Bootstrap-4
Coursera Front-End Web UI Frameworks and Tools: Bootstrap 4
superstar54/data-resources-for-materials-science
A list of databases, datasets and books/handbooks where you can find materials properties for machine learning applications.
superstar54/deepmd-kit
A deep learning package for many-body potential energy representation and molecular dynamics
superstar54/dft-book-espresso
New version of dft-book for Quantum Espresso
superstar54/invenio-communities
Invenio communities module.
superstar54/learn-docker
superstar54/matgenb
Jupyter notebooks demonstrating the utilization of open-source codes for the study of materials science.
superstar54/paperai
AI-powered literature discovery and review engine for medical/scientific papers
superstar54/pc2-practical-cc
PC-II Praktikum (HS 2020)
superstar54/pytest-blender
Pytest plugin for easy addons testing with Blender's Python interpreter.
superstar54/superstar54.github.io
superstar54/thase