lmmentel/deactivation-models lmmentel/deactivation-models

  • Stars
    star
    1
  • Language
    Python
  • Created almost 8 years ago
  • Updated almost 8 years ago
Twitter logo Share LinkedIn logo Share Facebook logo Share
lmmentel/deactivation-models
github

lmmentel

Reviews

There are no reviews yet. Be the first to send feedback to the community and the maintainers!

Repository Details

Catalyst deactivation and coke formation models

More Repositories

1

awesome-python-chemistry

A curated list of Python packages related to chemistry
961
star
2

awesome-time-series

Resources for working with time series and sequence data
417
star
3

mendeleev

A python package for accessing various properties of elements, ions and isotopes in the periodic table of elements.
Jupyter Notebook
183
star
4

chemtools

Python tools for quantum chemical calculations
Python
17
star
5

batchcalculator

Batch Calculator for Zeolite synthesis
Python
9
star
6

panthera

Python package for computing thermochemical properties of molecules and solids in the anharmonic approximation.
Python
4
star
7

pydmft

Python utilities for running density matrix functional theory (DMFT) quantum chemical calculations.
Python
3
star
8

mendeleevapp

Python
2
star
9

bmatrix

Python
1
star
10

gamess-us-fortran-interface

Fortran interface for GAMESS(US) allowing for reading gamess files
Fortran
1
star
11

raspberrypi-projects

Random collection of raspberry pi projects
C++
1
star
12

dashplotter

A dash app to quickly plot stacked scatter plots from csv files
Python
1
star
13

zeolite-classification

visualization of zeolite framework classifications
Jupyter Notebook
1
star
14

xrd-to-heatmap

X-ray tomgraphy data transformation
Jupyter Notebook
1
star
15

ase-jnb

jupyter notebooks with different viewers of ASE structures
Jupyter Notebook
1
star
16

srbogrid

Space-Reduced Bond-Order grid for diatomics
Jupyter Notebook
1
star
17

lmmentel.github.io

homepage
HTML
1
star
18

zefram

Python
1
star
19

vconstr

A suite of programs for reconstructing the exact Kohn-Sham potentials based on accurate densities.
Fortran
1
star