László von Szentpály

University of Stuttgart — Germany

Physics and Astronomy · Physical Sciences

27h-index10.5kcitations91works0.02yr avg
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Research Topics

Advanced Chemical Physics Studies(45), Spectroscopy and Quantum Chemical Studies(14), Atomic and Molecular Physics(12), Free Radicals and Antioxidants(11), Crystallography and molecular interactions(10)

Publications91 total

Conceptual Ruedenberg theory: From electronegativity to universal potential energy curve
Advances in quantum chemistry·2025
Contributors
Elsevier eBooks·2023
Introduction to Chemical Reactivity
Elsevier eBooks·2023· 2 cited
Conceptual Ruedenberg theory of chemical bonds: the necessary step beyond conceptual DFT
Elsevier eBooks·2023· 2 cited
Volume-based thermodynamics approach in the context of solid-state chemical reactivity analysis
Elsevier eBooks·2023
Introduction to Chemical Reactivity
Elsevier eBooks·2023· 1 cited
Contributors
Elsevier eBooks·2023
Valence‐State Concepts and Implications for <scp>CDFT</scp>
2022
Why and When Is Electrophilicity Minimized? New Theorems and Guiding Rules
The Journal of Physical Chemistry A·2020· 91 cited
Cover Feature: Understanding the Uniqueness of 2p Elements in Periodic Tables (Chem. Eur. J. 67/2020)
Chemistry - A European Journal·2020
Understanding the Uniqueness of 2p Elements in Periodic Tables
Chemistry - A European Journal·2020· 45 citedOpen Access
Theorems and rules connecting bond energy and bond order with electronegativity equalization and hardness maximization
Theoretical Chemistry Accounts·2020· 16 citedOpen Access
Correspondence on “Core Electron Topologies in Chemical Compounds: Case Study of Carbon versus Silicon”
Angewandte Chemie·2019· 3 cited
Correspondence on “Core Electron Topologies in Chemical Compounds: Case Study of Carbon versus Silicon”
Angewandte Chemie International Edition·2019· 3 cited
Eliminating symmetry problems in electronegativity equalization and correcting self‐interaction errors in conceptual DFT
Journal of Computational Chemistry·2018· 16 cited
Hardness maximization or equalization? New insights and quantitative relations between hardness increase and bond dissociation energy
Journal of Molecular Modeling·2017· 22 cited
Comment on “A new equation based on ionization energies and electron affinities of atoms for calculating of group electronegativity” by S. Kaya and C. Kaya [Comput. Theoret. Chem. 1052 (2015) 42–46]
Computational and Theoretical Chemistry·2016· 5 cited
Symmetry Laws Improve Electronegativity Equalization by Orders of Magnitude and Call for a Paradigm Shift in Conceptual Density Functional Theory
The Journal of Physical Chemistry A·2014· 23 cited
Physical Basis and Limitations of Equalization Rules and Principles: Valence-State Electronegativity and Valence-Pair-Affinity versus Operational Chemical Potential
Quantum Matter·2014· 10 cited
Comment on “Going beyond the frozen core approximation: Development of coordinate-dependent pseudopotentials and application to Na<sub>2</sub><sup>+</sup>” [J. Chem. Phys. 138, 054110 (2013)]
The Journal of Chemical Physics·2013· 2 citedOpen Access
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Frequent Co-authors

H. Preuß(8), Patricio Fuentealba(7), Hermann Stoll(7), Peter Schwerdtfeger(6), Cyril Párkányi(5), Hermann Stoll(3), Mame Diabou Gaye(3), Heinzwerner Preuß(2), J. Flad(2), Hans Kuhn(2), Christian Boniface(2), Jean‐Jacques Aaron(2), Ratna Ghosh(2), Devon O. Niel Gardner(2), H. Hesse(2), W. Fuhs(2), G. Weiser(2), Kelling J. Donald(2), Willem H. Mulder(2), F.X. Fraschio(2)