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List of works by Michael S Deleuze

A benchmark theoretical study of the electron affinities of benzene and linear acenes.

scientific article

Aromaticity of giant polycyclic aromatic hydrocarbons with hollow sites: super ring currents in super-rings

scientific article published on 01 July 2006

Benchmark theoretical study of the electric polarizabilities of naphthalene, anthracene, and tetracene

scientific article published on 01 January 2013

Bonding in negative ions: the role of d orbitals in the heavy analogues of pyridine and furan radical anions

scientific article published on 22 November 2010

Collision-energy-resolved Penning ionization electron spectroscopy of bromomethanes (CH3Br, CH2Br2, and CHBr3) by collision with He*(2(3)S) metastable atoms

scientific article published on 01 August 2004

Electron momentum spectroscopy of 1-butene: a theoretical analysis using molecular dynamics and molecular quantum similarity

scientific article published on 22 August 2013

Electron momentum spectroscopy of dimethyl ether taking account of nuclear dynamics in the electronic ground state

scientific article published on 01 October 2015

Electron momentum spectroscopy of norbornadiene at the benchmark ADC(3) level.

scientific article published on September 2010

Focal point analysis of the singlet-triplet energy gap of octacene and larger acenes

scientific article published on 01 August 2011

Formation of satellite bands in the ionization spectra of extended systems

scientific article published on 01 May 1996

From sulfoxide precursors to model oligomers of conducting polymers.

scientific article

Green's function study of the one-electron and shake-up ionization spectra of unsaturated hydrocarbon cage compounds

scientific article published on 01 November 2006

Half-metallicity and spin-contamination of the electronic ground state of graphene nanoribbons and related systems: an impossible compromise?

scientific article published in September 2011

Half-metallicity of graphene nanoribbons and related systems: a new quantum mechanical El Dorado for nanotechnologies... or a hype for materials scientists?

scientific article published on 24 July 2012

Imaging momentum orbital densities of conformationally versatile molecules: a benchmark theoretical study of the molecular and electronic structures of dimethoxymethane

scientific article published on 13 June 2007

Investigation into the Valence Electronic Structure of Norbornene Using Electron Momentum Spectroscopy, Green's Function, and Density Functional Theories

scientific article published in October 2005

Norbornane: an investigation into its valence electronic structure using electron momentum spectroscopy, and density functional and Green's function theories.

scientific article published in December 2004

Photoelectron and electron momentum spectroscopy of tetrahydrofuran from a molecular dynamical perspective

scientific article published on 20 February 2013

Probing molecular conformations with electron momentum spectroscopy: the case of n-butane.

scientific article published in May 2001

Probing nuclear dynamics in momentum space: a new interpretation of (e, 2e) electron impact ionization experiments on ethanol.

scientific article published in June 2009

Probing the shape and stereochemistry of molecular orbitals in locally flexible aromatic chains: a penning ionization electron spectroscopy and Green's function study of the electronic structure of biphenyl

scientific article published on 01 November 2005

Quantum chemical study of conformational fingerprints in the photoelectron spectra and (e, 2e) electron momentum distributions of n-hexane.

scientific article published in April 2010

Size-consistency aspects and physical interpretation of many-body Green's-function calculations on extended chains.

scientific article published in December 1992

Study of the molecular structure, ionization spectrum, and electronic wave function of 1,3-butadiene using electron momentum spectroscopy and benchmark Dyson orbital theories

scientific article published on 01 September 2006

Study of the valence wave function of thiophene with high resolution electron momentum spectroscopy and advanced Dyson orbital theories.

scientific article

The band 12 issue in the electron momentum spectra of norbornane: a comparison with additional Green's Function calculations and ultraviolet photoemission measurements

scientific article published on 01 May 2005

The fate of dicationic states in molecular clusters of benzene and related compounds.

scientific article published in December 2005

Theoretical study of molecular vibrations in electron momentum spectroscopy experiments on furan: an analytical versus a molecular dynamical approach

scientific article published on 01 March 2015

Theoretical study of the fragmentation pathways of norbornane in its doubly ionized ground state.

scientific article published on 4 October 2007

Theoretical study of the internal conversion of sulfoxide precursors of poly-isothianaphthene and related polymers

scientific article published on 01 January 2004

Theoretical study of the internal elimination reactions of xanthate precursors ⬇️

scientific article published on December 1, 2003

Theoretical study of the oxidation mechanisms of naphthalene initiated by hydroxyl radicals: the H abstraction pathway

scientific article published on 08 May 2014

Theoretical study of the oxidation mechanisms of naphthalene initiated by hydroxyl radicals: the O2 addition reaction pathways.

scientific article

Theoretical study of the oxidation mechanisms of naphthalene initiated by hydroxyl radicals: the OH-addition pathway.

scientific article

Theoretical study of the oxidation mechanisms of thiophene initiated by hydroxyl radicals

scientific article published on 03 November 2015

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