Pinned Repositories
2D_dielectric
2D dielectric calculation using GPAW+ASE
py-wdf-reader
Python package for read-only accessing the wdf Raman spectroscopy from Ranishaw WiRE software
SGI
Simpe Goniometer Interface powered by Python + Qt5
beautiful-atoms
Python module for drawing and rendering beautiful atoms and molecules using Blender.
SPARC
Simulation Package for Ab-initio Real-space Calculations
SPARC-X-API
vasp-interactive
alchem0x2A's Repositories
alchem0x2A/py-wdf-reader
Python package for read-only accessing the wdf Raman spectroscopy from Ranishaw WiRE software
alchem0x2A/math-methods-chemical-engineering
Course notes for the CMU course 06-262 Math Methods of Chemical Engineering (ODE's, linear algebra, PDEs, stats) in the form of jupyter notebooks
alchem0x2A/vasp-interactive-test
tests for vasp-interactive mode
alchem0x2A/.emacs.d
My .emacs.d configuration
alchem0x2A/Awesome-CV
:page_facing_up: Awesome CV is LaTeX template for your outstanding job application
alchem0x2A/beautiful-atoms
Python module for drawing and rendering beautiful atoms and molecules using Blender.
alchem0x2A/beautiful-atoms-api
Blendase is a Python package for drawing and rendering atoms, molecules and crystal using blender.
alchem0x2A/beautiful-atoms-docs
Document for Beautiful Atoms
alchem0x2A/blender
Official mirror of Blender
alchem0x2A/compas
Core packages of the COMPAS framework.
alchem0x2A/docker-images
Collection of personal-use container images
alchem0x2A/example-docker-qe
Example QE docker image for socket communication
alchem0x2A/figurefirst
A layout-first approach to figure making
alchem0x2A/gitignore
A collection of useful .gitignore templates
alchem0x2A/godaddy-ddns
A script for dynamically updating a GoDaddy DNS record. I use GoDaddy to host DNS for a domain and I wanted to point an A record in that domain to a host who's IP address changes occasionally. GoDaddy has an API to do this, so this happened. Cf. thatjpk/cloudflare-ddns.
alchem0x2A/i-pi
i-PI: a universal force engine
alchem0x2A/kct-image
Dockerized image of kindle x-tools from `koreader/koxtoolchain`
alchem0x2A/libbeef_py
Simple python interface to handle BEEF-vdW ensemble calculations
alchem0x2A/mbhl-public-demo
Demo repository for MBHL project (on binder)
alchem0x2A/my_CV
My personal CV
alchem0x2A/ocp-fork
Forked project from https://opencatalystproject.org/
alchem0x2A/packmol-feedstock
A conda-smithy repository for packmol.
alchem0x2A/pycse
Python computations in science and engineering
alchem0x2A/rclone_python
rclone python wrapper
alchem0x2A/SPARC
Simulation Package for Ab-initio Real-space Calculations
alchem0x2A/SPARC-X-API
alchem0x2A/sparc-x-api-feedstock
A conda-smithy repository for sparc-x-api.
alchem0x2A/sparc-x-feedstock
A conda-smithy repository for sparc-x.
alchem0x2A/staged-recipes
A place to submit conda recipes before they become fully fledged conda-forge feedstocks
alchem0x2A/uoa_che358_mock
Mock lecture for che358