Example code for enclosing points in an elipsoid

Automatically generates FORtran Documentation from comments within the code.

This add-on to pymatgen provides tools for analyzing diffusion in materials.

Nudged Elastic Band implementation that uses the PIMAIM molecular dynamics code for evaluating image forces

After performing a Spotlight search for pdfs, finds a string in those pdfs and prints the extract in context (set number of words before and after the search string). Currently outputs in a (bad) M…

FastScript scripts

Analysis code for pimaim MD code

A collection of command line utilities for manipulating VASP input / outpu

rb-appscript designed to run as a OS X service to jump from a remote directory in Terminal to the same directory in a new Transmit window