Andrew S. Rosen (@Andrew-S-Rosen)
github

Andrew-S-Rosen

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  • Stars
    star
    295
  • Global Rank 90,261 (Top 4 %)
  • Followers 294
  • Following 459
  • Registered about 10 years ago
  • Most used languages
    Python
         90.0 %
    MATLAB
         10.0 %
  • Location 🇺🇸 United States
  • Country Total Rank 29,164
  • Country Ranking
    MATLAB
         2,619
    Python
         3,978

Top repositories

1

QMOF

The QMOF Database: A database of quantum-mechanical properties for metal-organic frameworks.
Python
120
star
2

periodic_trends

Python script to plot periodic trends as a heat map over the periodic table of elements
Python
85
star
3

quacc

A flexible platform for high-throughput, database-driven computational materials science and quantum chemistry.
Python
35
star
4

mof_screen

High-throughput DFT of MOFs using ASE/VASP
Python
24
star
5

xtb_ase

A fully featured ASE calculator for xTB
Python
12
star
6

mof-adsorbate-initializer

Python code to initialize adsorbates on MOFs
Python
9
star
7

covalent-hpc-plugin

Covalent plugin for HPC batch job schedulers (e.g. Slurm, PBS, LSF, Flux, Cobalt) built around PSI/J
Python
9
star
8

MKMlab

MATLAB program for microkinetic modeling in catalysis
MATLAB
6
star
9

coapy

A Python package to generate collaborator info for NSF COA forms
Python
4
star
10

VaxChecker

Automatically query Vaxxmax for COVID-19 vaccines in your area
Python
2
star