Concepedia

Danuta Rusińska‐Roszak

DR

12

Publications

466

Citations

10

H-Index

1995

Active since

Affiliations

Poznań University of Technology(Current)

University of Tübingen

Danuta Rusińska‐Roszak is an author at Poznań University of Technology specializing in computational chemistry, chemistry, and quantum chemistry.

Top concepts

HydrogenChemistryEngineeringNatural SciencesQuantum ChemistryComputational ChemistryBiophysicsBiochemistryPhysical ChemistryBiomolecular Engineering

Publications per year

1995–2023

12

Publications

12

Hydrogen Bonding and Density Functional Calculations: The B3LYP Approach as the Shortest Way to MP2 Results

Marek Łożyński, Danuta Rusińska‐Roszak, Hans‐Georg Mack · The Journal of Physical Chemistry A · 1998 · 164 citations

Engineering, Computational Chemistry, Chemistry +17

Intramolecular O–H···O═C Hydrogen Bond Energy via the Molecular Tailoring Approach to RAHB Structures

Danuta Rusińska‐Roszak · The Journal of Physical Chemistry A · 2015 · 61 citations

Engineering, Intramolecular Hydrogen Bond, Natural Sciences +14

Estimation of the Intramolecular O–H···O═C Hydrogen Bond Energy via the Molecular Tailoring Approach. Part I: Aliphatic Structures

Danuta Rusińska‐Roszak, Grzegorz Sowinski · Journal of Chemical Information and Modeling · 2014 · 48 citations

Engineering, Intramolecular Hydrogen Bond, Natural Sciences +15

MP2 and Density Functional Studies of Hydrogen Bonding in Model Trioses: <scp>d</scp>-(+)-Glyceraldehyde and Dihydroxyacetone

Marek Łożyński, Danuta Rusińska‐Roszak, Hans‐Georg Mack · The Journal of Physical Chemistry A · 1997 · 46 citations

Engineering, Computational Chemistry, Chemistry +17

Energy of Intramolecular Hydrogen Bonding in ortho-Hydroxybenzaldehydes, Phenones and Quinones. Transfer of Aromaticity from ipso-Benzene Ring to the Enol System(s)

Danuta Rusińska‐Roszak · Molecules · 2017 · 43 citations · Full text

Rows per page

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