acrutt
PhD in Materials Science & Engineering with a focus on computational materials discovery for batteries
San Francisco Bay Area, California
Pinned Repositories
acr_tools
acrutt.github.io
atomate
atomate is a powerful software for computational materials science and contains pre-built workflows.
custodian
A simple, robust and flexible just-in-time job management framework in Python.
docs
Materials Project Documentation
emmet
Be a master builder of databases of material properties. Avoid the Kragle.
handbook
Persson Group Handbook
maggma
MongoDB aggregation machine
MPContribs
Platform for materials scientists to contribute and disseminate their materials data through Materials Project
NEB_PathFinder
acrutt's Repositories
acrutt/acr_tools
acrutt/acrutt.github.io
acrutt/atomate
atomate is a powerful software for computational materials science and contains pre-built workflows.
acrutt/custodian
A simple, robust and flexible just-in-time job management framework in Python.
acrutt/docs
Materials Project Documentation
acrutt/emmet
Be a master builder of databases of material properties. Avoid the Kragle.
acrutt/handbook
Persson Group Handbook
acrutt/maggma
MongoDB aggregation machine
acrutt/MPContribs
Platform for materials scientists to contribute and disseminate their materials data through Materials Project
acrutt/NEB_PathFinder
acrutt/pymatgen
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.
acrutt/pymatgen-analysis-diffusion
This add-on to pymatgen provides tools for analyzing diffusion in materials.
acrutt/python-fundamentals
Introductory Python Series for UC Berkeley's D-Lab
acrutt/workshop
The Materials Project Workshop Curriculum