phasesresearchlab Goto Github PK
Name: Phases Research Lab
Type: Organization
Bio: Research group lead by Dr. Zi-Kui Liu at The Pennsylvania State University.
Location: Pennsylvania State University, University Park, PA
Blog: phaseslab.org
Name: Phases Research Lab
Type: Organization
Bio: Research group lead by Dr. Zi-Kui Liu at The Pennsylvania State University.
Location: Pennsylvania State University, University Park, PA
Blog: phaseslab.org
Additive Manufacturing Mapping of Compositional Spaces with Thermodynamic, Analytical, and Artificial Intelligence Models
Density functional theory workflows for finite temperature thermodynamics based on atomate workflows.
An index of all class resources our group members are involved in! Deploys a website at:
Density functional theory workflows for finite temperature thermodynamics based on atomate workflows.
DFTTK is a Python package for automating VASP workflows and storing the relevant results on MongoDB.
Fitting thermodynamic models with pycalphad - https://doi.org/10.1557/mrc.2019.59
Build and deploy native installers of Anaconda with ESPEI and pycalphad for Windows, macOS and Linux
Datasets to be used by ESPEI. CC-BY-4.0
Skeleton code for making packages that provide custom unary reference states.
MaterialsMap is Python package for mapping properties, manufacturing feasibility, and desirability. We focus on guiding materials design graphically while proving API to underlying methods.
MHDB is a comprehensive suite designed to facilitate thermodynamic calculations and provide shared access to thermodynamic databases related to Metal Hydrides for H2 storage.
Implements a thermodynamic model developed by Darling et al. (Comput. Mater. Sci., vol. 84, pp. 255–266, 2014) to understand grain size stability in nano-sized alloys
Tools for implementing and consuming OPTIMADE APIs in Python modified for MPDD Database deployment
Parser for thermodynamic data stored in POP files.
Phases Research Lab Onboarding
High-throughput workflows and scripts for the Phases Research Lab with atomate
A neat template for creating an index of all projects your group is working on! Contributions can be done from web interface to keep the energy barrier low and allow all members to occur in the contributors ensemble.
The curated list of Phases Research Lab / Zi-Kui Liu Group Publications, Books, Theses, and More
PyQAlloy: Python tools for ensuring the Quality of Alloys data
Python python toolset for Structure-Informed Property and Feature Engineering with Neural Networks. It offers unique advantages through (1) effortless extensibility, (2) optimizations for ordered, dilute, and random atomic configurations, and (3) automated model tuning.
pySIPFENN repository trimmed to cover only the Feb 2023 workshop material.
An index of all software our group members are working on! Deploys a website at:
A place to submit conda recipes before they become fully fledged conda-forge feedstocks
A template repository for contributing to the ULTERA Database. Simply (1) fork it, (2) fill out the template, and (3) let us know the link.
Staging repository for contributions on Zentropy to the upcoming MGF Open Textbook on Thermodynamics
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.