Academic Bibliography

Search 200 years of publications by Ghent University researchers.

Leonid Maximowitsch Komissarov

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- Journal Article
- A1
- open access
A reactive molecular dynamics study of chlorinated organic compounds : part II : a ChemTraYzer study of chlorinated dibenzofuran formation and decomposition processes

Lukas Krep, Felix Schmalz, Florian Solbach, Leonid Maximowitsch Komissarov, Thomas Nevolianis, Wassja A. Kopp, Toon Verstraelen (UGent) and Kai Leonhard

(2023) CHEMPHYSCHEM. 24(7).
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- Journal Article
- A1
- open access
A reactive molecular dynamics study of chlorinated organic compounds, part I : force field development

Leonid Maximowitsch Komissarov, Lukas Krep, Felix Schmalz, Wassja A. Kopp, Kai Leonhard and Toon Verstraelen (UGent)

(2023) CHEMPHYSCHEM. 24(8).
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- PhD Thesis
Optimizing potential energy surface models

Leonid Maximowitsch Komissarov

(2022)
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- Journal Article
- A1
- open access
Zeo-1 : a computational data set of zeolite structures

Leonid Maximowitsch Komissarov and Toon Verstraelen (UGent)

(2022) SCIENTIFIC DATA. 9(1).
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- Journal Article
- A1
- open access
Improving the silicon interactions of GFN-xTB

Leonid Maximowitsch Komissarov and Toon Verstraelen (UGent)

(2021) JOURNAL OF CHEMICAL INFORMATION AND MODELING. 61(12). p.5931-5937
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- Journal Article
- A1
- open access
ParAMS : Parameter optimization for Atomistic and Molecular Simulations

Leonid Maximowitsch Komissarov, Robert Rüger, Matti Hellström and Toon Verstraelen (UGent)

(2021) JOURNAL OF CHEMICAL INFORMATION AND MODELING. 61(8). p.3737-3743