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List of works by Yannick Carissan

A study of the correlation effects upon the modelization of the double exchange phenomenon

scientific article published on 01 November 2004

Accurate coupled cluster calculations of the reaction barrier heights of two CH3* + CH4 reactions

scientific article published on 01 October 2009

Calculation of the ground and excited states of a mixed valence compound [Fe2(OH)3(NH3)6]2+: a class II or class III compound?

scientific article published in February 2004

Cyclobishelicenes: Shape-Persistent Figure-Eight Aromatic Molecules with Promising Chiroptical Properties

scientific article published on 09 October 2019

Density functional study of methyl chemisorption on polycyclic aromatic hydrocarbons

scientific article published on 01 June 2006

Growing graphene sheets from reactions with methyl radicals: a quantum chemical study

scientific article published on 01 August 2006

Hückel-Lewis projection method: a "weights watcher" for mesomeric structures

scientific article published in December 2008

Labile ligands on some Lewis super acids: a computational study

scientific article published on 19 June 2009

On the ring-opening of substituted cyclobutene to benzocyclobutene: analysis of π delocalization, hyperconjugation, and ring strain

scientific article published in 2014

Pseudopotentials for hybridized carbon atoms

Recasting wave functions into valence bond structures: A simple projection method to describe excited states

scientific article published on 20 January 2016

Reply to the 'Comment on "trans-1,2-Disiloxybenzocyclobutene, an adequate partner for the auto-oxidation: EPR/spin trapping and theoretical studies"' by H.-G. Korth, P. Mulder and T. Paul, Phys. Chem. Chem. Phys., 2017, 19, C6CP04187F.

scientific article published on 9 January 2017

Stereoselective Syntheses, Structures, and Properties of Extremely Distorted Chiral Nanographenes Embedding Hextuple Helicenes

scientific article published on 08 January 2020

The interaction of beryllium with benzene and graphene: a comparative investigation based on DFT, MP2, CCSD(T), CAS-SCF and CAS-PT2.

scientific article published in February 2014

Theoretical Studies of Autoxidation of 2-Alkylidene-1,3-cyclohexadione Leading to Bicyclic-Hemiketal Endoperoxides

scientific article published on 01 September 2017

trans-1,2-Disiloxybenzocyclobutene, an adequate partner for the auto-oxidation: EPR/spin trapping and theoretical studies

scientific article published on 01 April 2014

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