Search filters

List of works by Istvan Szabó

Accurate ab initio potential energy surface, thermochemistry, and dynamics of the F(-) + CH3F SN2 and proton-abstraction reactions

scientific article published on 01 June 2015

Anomalously Large Spectral Shifts near the Quantum Tunnelling Limit in Plasmonic Rulers with Subatomic Resolution

scientific article published on 19 February 2019

Benchmark ab Initio Characterization of the Complex Potential Energy Surface of the Cl- + CH3I Reaction

scientific article published on 10 July 2017

Deciphering Front-Side Complex Formation in SN2 Reactions via Dynamics Mapping.

scientific article

Double-inversion mechanisms of the X⁻ + CH₃Y [X,Y = F, Cl, Br, I] SN2 reactions

scientific article published on 13 March 2015

Dynamics and Novel Mechanisms of SN2 Reactions on ab Initio Analytical Potential Energy Surfaces.

scientific article published on 6 October 2017

High-level ab initio potential energy surface and dynamics of the F- + CH3I SN2 and proton-transfer reactions.

scientific article

Influence of the leaving group on the dynamics of a gas-phase SN2 reaction

scientific article

Inhibiting Analyte Theft in Surface-Enhanced Raman Spectroscopy Substrates: Subnanomolar Quantitative Drug Detection

scientific article published on 01 November 2019

Mode-Specific SN2 Reaction Dynamics.

scientific article

Mode-specific multi-channel dynamics of the F- + CHD2Cl reaction on a global ab initio potential energy surface

scientific article published on 01 October 2016

On the choice of the ab initio level of theory for potential energy surface developments

scientific article published on 08 January 2014

Revealing a double-inversion mechanism for the F⁻+CH₃Cl SN2 reaction.

scientific article

Room-Temperature Optical Picocavities below 1 nm3 Accessing Single-Atom Geometries

article

Rotational Mode Specificity in the F(-) + CH3Y [Y = F and Cl] SN2 Reactions

scientific article published on 21 August 2015

Smart supramolecular sensing with cucurbit[n]urils: probing hydrogen bonding with SERS.

scientific article published on 21 September 2017

Temperature-dependent, effective structures of the 14NH3 and 14ND3 molecules.

scientific article published on 25 April 2012

Tracking Nanoelectrochemistry Using Individual Plasmonic Nanocavities.

scientific article