kcantosh Goto Github PK
Type: User
Company: University
Bio: I am a condensed matter physicist and a material scientist by profession.
Location: USA
Type: User
Company: University
Bio: I am a condensed matter physicist and a material scientist by profession.
Location: USA
A collection of tools for simulating vibrational spectra, which interfaces with the Phonopy package.
This is a bash script which enable us to calculate forces of displacemented crystal structure made by Phonopy using VASP code. It's tested on a Linux cluster system.
pix2code: Generating Code from a Graphical User Interface Screenshot
A practical approach to learning machine learning.
Project #1: DFT+U Universal Input File Generation Scheme for Quantum Espresso v.5.0.1
PROPhet is a code to integrate machine learning techniques with first-principles quantum chemistry approaches
Open-Source Quantum Chemistry – an electronic structure package in C++ driven by Python
An short example based guide to pycalphad.
Utilities for scientific analysis of nanoscale imaging modalities such as scanning probe microscopy, scanning tunneling spectroscopy, x-ray diffraction microscopy, and transmission electron microscopy
Python Materials Genomics (pymatgen) is a robust materials analysis code that defines core object representations for structures and molecules with support for many electronic structure codes. It is currently the core analysis code powering the Materials Project.
IPython Notebooks to learn Python
The "Python Machine Learning" book code repository and info resource
Repository to store all the Python Textbook Companions.
Python Data Science Handbook: full text in Jupyter Notebooks
Practice and tutorial-style notebooks covering wide variety of machine learning techniques
Python module for interfacing with the CQC t|ket> library of quantum software
Check out improved:
PyTorch Tutorial for Deep Learning Researchers
Introduction to Spectral and Image processing in Python
A python package to compute zero-field-splitting tensors for molecules and spin quantum bits in semiconductors.
Official mirror of Quantum ESPRESSO
Qball (also known as qb@ll) is a first-principles molecular dynamics code that is used to compute the electronic structure of atoms, molecules, solids, and liquids within the Density Functional Theory (DFT) formalism. It is a fork of the Qbox code by Francois Gygi.
Quantum Nature
QMCPACK Users Workshop 2019
:rocket: Introduction to Quantum Computing and Quantum Algorithms with IBM Qiskit and D-Wave :mortar_board:
A Virtual Machine for computational materials science
A Python code to quickly derive ab initio parameterized force fields.
libAtoms/QUIP molecular dynamics framework: http://www.libatoms.org
QuTiP: Quantum Toolbox in Python
R for data science
A declarative, efficient, and flexible JavaScript library for building user interfaces.
🖖 Vue.js is a progressive, incrementally-adoptable JavaScript framework for building UI on the web.
TypeScript is a superset of JavaScript that compiles to clean JavaScript output.
An Open Source Machine Learning Framework for Everyone
The Web framework for perfectionists with deadlines.
A PHP framework for web artisans
Bring data to life with SVG, Canvas and HTML. 📊📈🎉
JavaScript (JS) is a lightweight interpreted programming language with first-class functions.
Some thing interesting about web. New door for the world.
A server is a program made to process requests and deliver data to clients.
Machine learning is a way of modeling and interpreting data that allows a piece of software to respond intelligently.
Some thing interesting about visualization, use data art
Some thing interesting about game, make everyone happy.
We are working to build community through open source technology. NB: members must have two-factor auth.
Open source projects and samples from Microsoft.
Google ❤️ Open Source for everyone.
Alibaba Open Source for everyone
Data-Driven Documents codes.
China tencent open source team.