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10 results in Authors: Marc H. Garner

Theoretical and Computational Chemistry

Working Paper

The Bicyclo[2.2.2]octane Motif: A Class of Saturated Group 14 Quantum Interference Based Single-molecule Insulators

Marc H. Garner, Mads Koerstz, Jan H. Jensen, Gemma C. Solomon

Version 1 posted 29 October 2018

870

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Physical Chemistry

Working Paper

Quantification of the Helicality of Helical Molecular Orbitals

William Bro-Jørgensen, Marc H. Garner, Gemma C. Solomon

Version 1 posted 30 June 2021

342

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Physical Chemistry

Working Paper

Helical versus linear Jahn-Teller distortions in allene and spiropentadiene radical cations

Marc H. Garner, Rubén Laplaza, Clemence Corminboeuf

Version 1 posted 29 July 2022

195

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Physical Chemistry

Working Paper

The fundamental relation between electrohelicity and molecular optical activity

Marc H. Garner, Clemence Corminboeuf

Version 1 posted 24 March 2023

326

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Theoretical and Computational Chemistry

Working Paper

Substituent Control of σ-interference Effects in the Transmission of Saturated Molecules

Marc H. Garner, Mads Koerstz, Jan H. Jensen, Gemma C. Solomon

Version 1 posted 22 December 2021

274

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Materials Chemistry

Working Paper

Aromaticity-driven singlet-triplet inversions

J. Terence Blaskovits, Marc H. Garner, Clemence Corminboeuf

Version 1 posted 08 December 2022

580

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Physical Chemistry

Working Paper

Enhanced inverted singlet-triplet gaps in azaphenalenes and non-alternant hydrocarbons

Marc H. Garner, J. Terence Blaskovits, Clémence Corminboeuf

Version 1 posted 23 November 2023

306

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Physical Chemistry

Working Paper

Excited-state Hund’s Rule Violations in Bridged [10]- and [14]Annulene Perimeters

J. Terence Blaskovits, Clemence Corminboeuf, Marc H. Garner

Version 1 posted 17 June 2024

224

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Physical Chemistry

Working Paper

Double-bond delocalization in non-alternant hydrocarbons induces inverted singlet-triplet gaps

Marc H. Garner, J. Terence Blaskovits, Clemence Corminboeuf

Version 1 posted 04 July 2023

316

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Physical Chemistry

Working Paper

Singlet-Triplet Inversions in Through-Bond Charge-Transfer States

J. Terence Blaskovits, Clémence Corminboeuf, Marc H. Garner

Version 1 posted 02 August 2024

333

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10 results in Marc H. Garner in Authors: Marc H. Garner

The Bicyclo[2.2.2]octane Motif: A Class of Saturated Group 14 Quantum Interference Based Single-molecule Insulators

Quantification of the Helicality of Helical Molecular Orbitals

Helical versus linear Jahn-Teller distortions in allene and spiropentadiene radical cations

The fundamental relation between electrohelicity and molecular optical activity

Substituent Control of σ-interference Effects in the Transmission of Saturated Molecules

Aromaticity-driven singlet-triplet inversions

Enhanced inverted singlet-triplet gaps in azaphenalenes and non-alternant hydrocarbons

Excited-state Hund’s Rule Violations in Bridged [10]- and [14]Annulene Perimeters

Double-bond delocalization in non-alternant hydrocarbons induces inverted singlet-triplet gaps

Singlet-Triplet Inversions in Through-Bond Charge-Transfer States

10 results in Authors: Marc H. Garner