Casper Steinmann (@cstein)
github

cstein

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  • Stars
    star
    59
  • Global Rank 302,023 (Top 11 %)
  • Followers 76
  • Following 21
  • Registered about 15 years ago
  • Most used languages
    Python
         81.8 %
    Fortran
         18.2 %
  • Location 🇩🇰 Denmark
  • Country Total Rank 1,305
  • Country Ranking
    Fortran
         8
    Python
         267

Top repositories

1

neb

Nudged-Elastic Band implementation in python
Python
23
star
2

calcit

code to calculate things with
Python
6
star
3

qfitlib

QFITLIB: A library to do multipole fitting in quantum chemistry codes
Fortran
6
star
4

tabulated-spectra

Tabulated spectra from the scientific litterature
5
star
5

blogsamples

code samples from the blog
Python
3
star
6

mpi_examples

Examples of MPI
Python
2
star
7

GB-GA_docking_supporting_information

Supporting information for our GB-GA work
Python
2
star
8

megawordsmemoryconverter

Tiny python script to convert between megawords and megabytes
1
star
9

dalton-scripts

Useful (homemade) scripts for Dalton
Python
1
star
10

mblib

This general many-body library enables you to calculate the energy (and energy derived properties) to any order when you interface it properly to a quantum chemistry code.
Fortran
1
star
11

molecularrotations

A tiny framework for rotations
Python
1
star
12

fmo-ie-analyzer

GUI for analyzing FMO interaction energies.
Python
1
star
13

autoencoder

Python
1
star