Size dependences of the diradical character and the second hyperpolarizabilities in dicyclopenta-fused acenes: relationships with their aromaticity/antiaromaticity

(Hyper)polarizability density analysis for open-shell molecular systems based on natural orbitals and occupation numbers

(2011) Masayoshi Nakano et al.   THEORETICAL CHEMISTRY ACCOUNTS

Isolation of the Triplet Ground State Aminyl Diradical

(2010) Przemysław J. Boratyński et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Photogeneration of Octacene and Nonacene

(2010) Christina Tönshoff et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Signature of multiradical character in second hyperpolarizabilities of rectangular graphene nanoflakes

(2010) Hiroshi Nagai et al.   CHEMICAL PHYSICS LETTERS

Theoretical Design of High-Spin Polycyclic Hydrocarbons

(2010) Georges Trinquier et al.   CHEMISTRY-A EUROPEAN JOURNAL

Long-range corrected density functional theory study on static second hyperpolarizabilities of singlet diradical systems

(2010) Sean Bonness et al.   JOURNAL OF CHEMICAL PHYSICS

Ring Current Model and Anisotropic Magnetic Response of Cyclopropane

(2010) Raphaël Carion et al.   Journal of Chemical Theory and Computation

Novel properties of graphene nanoribbons: a review

(2010) Sudipta Dutta et al.   JOURNAL OF MATERIALS CHEMISTRY

Biradicaloid and Polyenic Character of Quinoidal Oligothiophenes Revealed by the Presence of a Low-Lying Double-Exciton State

(2010) Simone Di Motta et al.   Journal of Physical Chemistry Letters

Resonating Valence Bond and σ-Charge Density Wave Phases in a Benzannulated Phenalenyl Radical

(2010) Pradip Bag et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Synthesis and Characterization of Teranthene: A Singlet Biradical Polycyclic Aromatic Hydrocarbon Having Kekulé Structures

(2010) Akihito Konishi et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Is There a Lower Limit to the CC Bonding Distances in Neutral Radical π-Dimers? The Case of Phenalenyl Derivatives

(2010) Yong-Hui Tian et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Single-Crystal X-ray Structure of 1,3-Dimethylcyclobutadiene by Confinement in a Crystalline Matrix

(2010) Y.-M. Legrand et al.   SCIENCE

Resonance Balance Shift in Stacks of Delocalized Singlet Biradicals

(2009) Akihiro Shimizu et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Third-order nonlinear optical properties of trigonal, rhombic and bow-tie graphene nanoflakes with strong structural dependence of diradical character

(2009) Kyohei Yoneda et al.   CHEMICAL PHYSICS LETTERS

Theoretical study on third-order nonlinear optical properties in hexagonal graphene nanoflakes: Edge shape effect

(2009) Hiroshi Nagai et al.   CHEMICAL PHYSICS LETTERS

Quinoidal Oligothiophenes: Towards Biradical Ground-State Species

(2009) Rocío Ponce Ortiz et al.   CHEMISTRY-A EUROPEAN JOURNAL

The electronic properties of graphene

(2009) A. H. Castro Neto et al.   REVIEWS OF MODERN PHYSICS

Theoretical study of third-order nonlinear optical properties in square nanographenes with open-shell singlet ground states

(2008) Masayoshi Nakano et al.   CHEMICAL PHYSICS LETTERS

A bottom-up approach from molecular nanographenes to unconventional carbon materials

(2008) Linjie Zhi et al.   JOURNAL OF MATERIALS CHEMISTRY

Electronic Ground State of Higher Acenes

(2007) De-en Jiang et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Aromaticity and magnetotropicity of dicyclopenta-fused polyacenes

(2007) Masakazu Makino et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS