benwmcdowell
PhD Candidate in Physical Chemistry Writing scripts for DFT post-processing, modeling quantum mechanics, and analysis of scanning probe experiments.
University of OregonEugene, OR
benwmcdowell's Stars
quantumlib/Cirq
A Python framework for creating, editing, and invoking Noisy Intermediate Scale Quantum (NISQ) circuits.
online-go/online-go.com
Source code for the Online-Go.com web interface
rescipy-project/spym
A python package for processing Scanning Probe Microscopy (SPM) data.
FelixDesrochers/Numerov
A python script that solves the one dimensional time-independent Schrodinger equation for bound states. The script uses a Numerov method to solve the differential equation and displays the desired energy levels and a figure with an approximate wave function for each of these energy levels.
caldarolamartin/read_sm4_files
A MATLAB code to read the propietary files sm4 from RHK technology.
scipy/scipy
SciPy library main repository
phonopy/phonopy
Phonon code
lucydot/vesta_vectors
A Python 3 script to visualise atomic displacement using the Vesta file format
usnistgov/jarvis
JARVIS-Tools: an open-source software package for data-driven atomistic materials design. Publications: https://scholar.google.com/citations?user=3w6ej94AAAAJ https://www.youtube.com/watch?v=2-XHeC8gbeY
opencv/opencv
Open Source Computer Vision Library
abred/DeepSPM
A machine learning approach allowing to acquire and classify data autonomously in multi-day Scanning Probe Microscopy experiments
matplotlib/matplotlib
matplotlib: plotting with Python
uqfoundation/pathos
parallel graph management and execution in heterogeneous computing
charmplusplus/charm4py
Parallel Programming with Python and Charm++
rehnd/VASP-plot-modes
Tool for plotting modes generated by DFPT calculations (IBRION=7 or 8) in VASP
Danil-phy-cmp-120/plot_forces_from_VASP
Plots the evolution of forces from VASP's OUTCAR file. Useful for analyzing optimization progression between or during job submissions.