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Lukasz Szeleszczuk
ORCID
Publication Activity (10 Years)
Years Active: 2018-2019
Publications (10 Years): 3
Top Topics
Molecular Dynamics
Phase Transition
Top Venues
J. Comput. Chem.
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Publications
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Lukasz Szeleszczuk
,
Dariusz Maciej Pisklak
,
Monika Zielinska-Pisklak
How does the NMR thermometer work? Application of combined quantum molecular dynamics and GIPAW calculations into the study of lead nitrate.
J. Comput. Chem.
40 (6) (2019)
Lukasz Szeleszczuk
,
Dariusz Maciej Pisklak
,
Monika Zielinska-Pisklak
Can we predict the structure and stability of molecular crystals under increased pressure? First-principles study of glycine phase transitions.
J. Comput. Chem.
39 (19) (2018)
Lukasz Szeleszczuk
,
Dariusz Maciej Pisklak
,
Monika Zielinska-Pisklak
Does the choice of the crystal structure influence the results of the periodic DFT calculations? A case of glycine alpha polymorph GIPAW NMR parameters computations.
J. Comput. Chem.
39 (14) (2018)