tyoon124

PyOECP

A purely Python-based flexible open-source software for estimating and modeling the complex permittivity obtained from the open-ended coaxial probe (OECP) technique.

AutoMapper

A package of tools for automating the file preparation for the LAMMPS fix bond/react.

bell2023centricity

Supporting Information Repository for the article "What is a centric factor?"

cavity-volumes-pbc

Voronoi-based calculation of cavities inside molecular dynamics models with periodic boundary conditions

citable-data

Data, in citable form, produced by the Coudert research group

d3

Bring data to life with SVG, Canvas and HTML. :bar_chart::chart_with_upwards_trend::tada:

DEWPython

lammps_interface

automatic generation of LAMMPS input files for molecular dynamics simulations of MOFs

mixturemodel

Statistical mixture models I (Inverse Gamma-Normal mixture)

phasepy

pymks

Materials Knowledge System in Python

pyoz

pyOZ: An iterative Ornstein-Zernike equation solver

tutorial

2023 추계 화학공학회 Tutorial 파일