Berlin, Germany

Jan Hermann

Expert
@jhrmnn

Computational chemistry & physics, electrons, deep learning

hrmnn.net

pyberny. Molecular structure optimizer

130

knitj. Alternative front-end to Jupyter kernels

49

mona. Calculation framework

13

fcompile. Fast Fortran build tool

7

doi2bibtex. DOI to BibTeX converter

6

xml2struct. Fast XML reader for Matlab

5

deepqmc. Deep learning quantum Monte Carlo for electrons in real space

3

codehash. Hashing Python code

2

dft2. Hartree-Fock/Kohn-Sham in Matlab

2

mona-demo. Python

2

covid. Jupyter Notebook

1

fanalyse. Static Fortran analyzer

1

fprettify. auto-formatter for modern fortran source code

1

dotfiles. Shell

1

pyfhiaims. Python

1

berny. Molecular structure optimizer

1
16
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