Daniel S. Lambrecht

Florida Gulf Coast University — United States

Physics and Astronomy · Physical Sciences

34h-index8.8kcitations83works0.02yr avg
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Research Topics

Advanced Chemical Physics Studies(23), Spectroscopy and Quantum Chemical Studies(18), Nuclear physics research studies(16), High-Energy Particle Collisions Research(8), Nuclear Physics and Applications(8)

Publications81 total

Analyzing the Solvent Effects in Palladium/ <i>N</i> -Heterocyclic Carbene (Pd/NHC)-Catalyzed Suzuki–Miyaura Coupling of Aryl Chlorides: A Computational Study of the Oxidative Addition Step with Experimental Validation
The Journal of Physical Chemistry B·2025Open Access
CH Mode Mixing Determines the Band Shape of the Carboxylate Symmetric Stretch in Apo-EDTA, Ca<sup>2+</sup>–EDTA, and Mg<sup>2+</sup>–EDTA
The Journal of Physical Chemistry A·2021· 20 cited
CCDC 2032771: Experimental Crystal Structure Determination
The Cambridge Structural Database·2021Open Access
CCDC 2032773: Experimental Crystal Structure Determination
The Cambridge Structural Database·2021Open Access
CCDC 2032772: Experimental Crystal Structure Determination
The Cambridge Structural Database·2021Open Access
CCDC 2032774: Experimental Crystal Structure Determination
The Cambridge Structural Database·2021Open Access
Molecular design principles of ionic liquids with a sulfonyl fluoride moiety
New Journal of Chemistry·2021· 14 cited
Mode mixing between the carboxylate symmetric stretch and CH bends cause the vibrational structures in EDTA, [Ca:EDTA]2-, [Mg:EDTA]2- spectrum
2020
Buckybowls as gas adsorbents: binding of gaseous pollutants and their electric-field induced release
Physical Chemistry Chemical Physics·2020· 8 citedOpen Access
Molecular Origin of Positive and Negative Electromechanical Response in Hydrogen-Bonded Systems
2019Open Access
Molecular Origin of Positive and Negative Electromechanical Response in Hydrogen-Bonded Systems
2019· 2 citedOpen Access
Oligomerization of Silyl Ketene: Favoring Chain Extension over Backbiting
Macromolecules·2019· 2 cited
Data for: Generalizing energy decomposition analysis to response properties to inform structure-property relations
Data Archiving and Networked Services (DANS)·2018Open Access
Generalizing energy decomposition analysis to response properties to inform expedited predictive models
Computational and Theoretical Chemistry·2018· 3 cited
A First Principles Approach for Partitioning Linear Response Properties into Additive and Cooperative Contributions
2018· 2 citedOpen Access
A First Principles Approach for Partitioning Linear Response Properties into Additive and Cooperative Contributions
2018· 4 citedOpen Access
Ligand–Substrate Dispersion Facilitates the Copper-Catalyzed Hydroamination of Unactivated Olefins
Journal of the American Chemical Society·2017· 256 citedOpen Access
Erratum: “Ultrafast vibrational spectroscopy (2D-IR) of CO2 in ionic liquids: Carbon capture from carbon dioxide’s point of view” [J. Chem. Phys. 142, 212425 (2015)]
The Journal of Chemical Physics·2017· 5 cited
Developing a Molecular Theory of Electromechanical Responses
arXiv (Cornell University)·2017· 2 citedOpen Access
Polybenzobisimidazole‐derived two‐dimensional supramolecular polymer
Journal of Polymer Science Part A Polymer Chemistry·2017· 8 cited
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Frequent Co-authors

Y. Leifels(13), Martin Head‐Gordon(10), Th. Blaich(10), H. Emling(10), H. Klingler(10), R. Kulessa(10), K. Stelzer(10), J. Stroth(10), E. Wajda(10), M. Zinser(10), E. Zude(10), Th. W. Elze(9), R. Holzmann(9), Christian Ochsenfeld(9), K. Grimm(8), J. G. Keller(8), H. Freiesleben(7), E. Lubkiewicz(6), W. Waluś(6), J. V. Kratz(6)