When cobalt-mediated [2 + 2 + 2] cycloaddition reaction dares go astray: synthesis of unprecedented cobalt( iii )-complexes
Marion Delorme
,
Alexander Punter
,
Raquel Oliveira
,
Corinne Aubert
,
Yannick Carissan
et al.
Journal articles
hal-02354762v1
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Résumé graphique de l'article intitulé "Recasting Wave Functions into Valence Bond Structures: A Simple Projection Method to Describe Excited States
Yannick Carissan
Illustration. France. 2019
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medihal-02095334v1
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Multidimensional Isotropic Magnetic Shielding Contour Maps for the Visualization of Aromaticity in ortho-Arynes and Their Reactions
Albert Artigas
,
Denis Hagebaum-Reignier
,
Yannick Carissan
,
Yoann Coquerel
Journal articles
hal-03856914v1
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Determination of the Rate Constant of the [4 + 2] Cycloaddition Between an Aryne Atropisomer and Furan in Solution
Guillaume Dauvergne
,
Nicolas Vanthuyne
,
Michel Giorgi
,
Jean Rodriguez
,
Yannick Carissan
et al.
Illustration. France. 2022
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hal-03777722v1
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Illustration de " A generalized Brillouin theorem (GBT)-like implementation to optimize Valence Bond wave function for excited states
Yannick Carissan
,
Denis Hagebaum-Reignier
,
Stéphane Humbel
,
Julien Racine
Illustration. France. 2017
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medihal-01587254v1
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Cyclobishelicenes: Shape-Persistent Figure-Eight Aromatic Molecules with Promising Chiroptical Properties
Antoine Robert
,
Guilaume Naulet
,
Harald Bock
,
Nicolas Vanthuyne
,
Marion Jean
et al.
Photography. France. 2019
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hal-02332131v1
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On the ring-opening of substituted cyclobutene to benzocyclobutene: analysis of pi delocalization, hyperconjugation, and ring strain
Paola Nava
,
Yannick Carissan
Journal articles
hal-01141483v1
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Tandem mass spectrometry of doubly charged poly(ethylene oxide) oligomers produced by electrospray ionization
Marion Girod
,
Yannick Carissan
,
Stéphane Humbel
,
Laurence Charles
Journal articles
istex
hal-01447597v1
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Trans-1,2-disiloxybenzocyclobutene, an adequate partner for the auto-oxisation: EPR/spin trapping and theoretical studies
Jean Drujon
,
Raphaël Rahmani
,
Virginie Héran
,
Romain Blanc
,
Yannick Carissan
et al.
Journal articles
hal-01066302v1
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trans-1,2-Disiloxybenzocyclobutene + O 2 & pseudopotentials for hybridized carbon atoms
Yannick Carissan
Joint EMLG/JMLG Annual Meeting , Janis Samios, Sep 2016, Platanias, Greece
Conference papers
hal-01408042v1
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Synthesis and Electron Accepting Properties of Two Di(benz[ f ]indenone)-Fused Tetraazaanthracene Isomers
Bruno Salgues
,
Rudraditya Sarkar
,
Muhammad Luthfi Fajri
,
Yatzil Alejandra Avalos-Quiroz
,
Anne-Doriane Manick
et al.
Illustration. France. 2022
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hal-03600306v1
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Investigation of Silicon Model Nanotubes as Potential Candidate Nanomaterials for Efficient Hydrogen Storage: A Combined Ab Initio/Grand Canonical Monte Carlo Simulation Study
George P. Lithoxoos
,
Jannis Samios
,
Yannick Carissan
Journal articles
istex
hal-01447596v1
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Periselectivity in the aza-Diels–Alder Cycloaddition between α-Oxoketenes and N -(5-Pyrazolyl)imines: A Combined Experimental and Theoretical Study
Juan-Carlos Castillo
,
Brian Castro Agudelo
,
Jaime Gálvez
,
Yannick Carissan
,
Jean Rodriguez
et al.
Journal articles
hal-02990649v1
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Computing the Local Aromaticity of Benzenoids Thanks to Constraint Programming
Yannick Carissan
,
Chisom-Adaobi Dim
,
Denis Hagebaum-Reignier
,
Nicolas Prcovic
,
Cyril Terrioux
et al.
26th International Conference on Principles and Practice of Constraint Programming , Sep 2020, Louvain-la-Neuve, Belgium. pp.673-689,
⟨10.1007/978-3-030-58475-7_39⟩
Conference papers
hal-02931928v1
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Weight Watchers électronique : calculez votre poids de formes résonantes
Yannick Carissan
,
Denis Hagebaum-Reignier
,
Stephane Humbel
,
Nicolas Goudard
L'Actualité Chimique , 2016, L'actualité chimique, 406, pp.36-40
Journal articles
hal-01347244v1
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Localized Structures at the Hückel Level, a Hückel-Derived Valence Bond Method
Yannick Carissan
,
Goudard Nicolas
,
Denis Hagebaum-Reignier
,
Stéphane Humbel
Applications of Topological Methods in Molecular Chemistry , 2016
Book sections
hal-02095737v1
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Atomic pseudopotentials for reproducing π-orbital electron behavior in sp 2 carbon atoms
Alexander Punter
,
Paola Nava
,
Yannick Carissan
Journal articles
hal-02048996v1
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A study of the correlation effects upon the modelization of the double exchange phenomenon
Jean-Louis Heully
,
Yannick Carissan
,
Nathalie Guihéry
,
Fabienne Alary
Journal articles
hal-00003423v1
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Illustration des performances des pseudo potentiels extraits dans la seconde version des pseudo potentiels anisotropes pour atomes hybridés.
Yannick Carissan
Photography. France. 2017
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medihal-01587555v1
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Synthesis and Electron Accepting Properties of Two Di(benz[f]indenone)-Fused Tetraazaanthracene Isomers
Bruno Salgues
,
Rudraditya Sarkar
,
Muhammad Fajri
,
Yatzil Avalos-Quiroz
,
Anne-Doriane Manick
et al.
Journal articles
hal-03594115v1
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How constraint programming can help chemists to generate Benzenoid structures and assess the local Aromaticity of Benzenoids
Yannick Carissan
,
Denis Hagebaum-Reignier
,
Nicolas Prcovic
,
Cyril Terrioux
,
Adrien Varet
et al.
Journal articles
hal-03684890v1
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Modèles en chimie théorique, développements et applications
Yannick Carissan
Chimie théorique et/ou physique. Aix Marseille Université, 2015
Habilitation à diriger des recherches
tel-01306829v1
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Stereoselective Syntheses, Structures and Properties of Extremely Distorted Chiral Nanographenes Embedding Hextuple Helicenes
Myriam Roy
,
Veronika Berezhnaia
,
Marco Villa
,
Nicolas Vanthuyne
,
Michel Giorgi
et al.
Journal articles
hal-03064338v1
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Synthesis and Characterization of a Dinuclear Copper Complex Bearing a Hydrophobic Cavity as a Model for Copper-Containing Monooxygenases
Olivier Schicke
,
Bruno Faure
,
Yannick Carissan
,
Michel Giorgi
,
Ariane Jalila Simaan
et al.
Journal articles
istex
hal-01475430v1
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Hydrogen abstraction from biphenyl, acenaphthylene, naphthalene and phenanthrene by atomic hydrogen and methyl radical: DFT and G3(MP2)-RAD data
Yannick Carissan
,
Wim Klopper
Journal articles
hal-01447590v1
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BenzAI: A Program to Design Benzenoids With Defined Properties Using Constraint Programming
Adrien Varet
,
Nicolas Prcovic
,
Cyril Terrioux
,
Denis Hagebaum-Reignier
,
Yannick Carissan
et al.
Journal articles
hal-03691364v1
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Synthesis, Photophysical Properties, and Aromaticity of Pyrazine-Fused Tetrazapentalenes
Vincent S Gutierrez
,
Axel Arnault
,
Véronique Ferreira
,
Albert Artigas
,
Denis Hagebaum-Reignier
et al.
Journal articles
hal-03856904v1
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Recasting Wave Functions into Valence Bond Structures: A Simple Projection Method to Describe Excited States
Julien Racine
,
Denis Hagebaum-Reignier
,
Yannick Carissan
,
Stephane Humbel
Journal articles
hal-01306875v1
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Mesomerism, Ring & Substituent Effects, A Computational Chemistry Experiments
Djameleddine Khatmi
,
Yannick Carissan
,
Denis Hagebaum-Reignier
,
Nicolas Goudard
,
Stéphane Humbel
et al.
Journal articles
hal-01347226v1
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On the Catalysis of the Cycloisomerization of 1,6-Dienes with Tin(IV) Salts: The Important Role of a Water Molecule
Paola Nava
,
Yannick Carissan
,
Jean Drujon
,
Fanny Grau
,
Julien Godeau
et al.
Journal articles
istex
hal-01347469v1
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