Theoretical chemist, computational chemistry researcher, developing quantum chemistry in Fortran, Python and C , packaging scientific software.
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Microsoft Research, AI for Science
- Amsterdam, Netherlands
- https://orcid.org/0000-0001-7809-771X
- in/sebastian-ehlert
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grimme-lab/xtb
grimme-lab/xtb PublicSemiempirical Extended Tight-Binding Program Package
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dftbplus/dftbplus
dftbplus/dftbplus PublicDFTB general package for performing fast atomistic simulations
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dftd4/dftd4
dftd4/dftd4 PublicGenerally Applicable Atomic-Charge Dependent London Dispersion Correction
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toml-f/toml-f
toml-f/toml-f PublicTOML parser implementation for data serialization and deserialization in Fortran
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