Diradical character dependence of third-harmonic generation spectra in open-shell singlet systems

para-Quinodimethane-Bridged Perylene Dimers and Pericondensed Quaterrylenes: The Effect of the Fusion Mode on the Ground States and Physical Properties

(2014) Soumyajit Das et al.   CHEMISTRY-A EUROPEAN JOURNAL

Third-Order Nonlinear Optical Properties of One-Dimensional Open-Shell Molecular Aggregates Composed of Phenalenyl Radicals

(2014) Kyohei Yoneda et al.   CHEMISTRY-A EUROPEAN JOURNAL

Theoretical Study on the Relationship between Diradical Character and Second Hyperpolarizabilities of Four-Membered-Ring Diradicals Involving Heavy Main-Group Elements

(2014) Hiroshi Matsui et al.   CHEMISTRY-A EUROPEAN JOURNAL

Third-Order Nonlinear Optical Properties and Electroabsorption Spectra of an Organic Biradical, [Naphtho[2,1-d:6,5-d′]bis([1,2,3]dithiazole)]

(2014) Keigo Takauji et al.   Journal of Physical Chemistry C

Theoretical study on the diradical characters and third-order nonlinear optical properties of cyclic thiazyl diradical compounds

(2013) Hiroshi Matsui et al.   CHEMICAL PHYSICS LETTERS

Diradical character dependences of the first and second hyperpolarizabilities of asymmetric open-shell singlet systems

(2013) Benoît Champagne   JOURNAL OF CHEMICAL PHYSICS

Signature of Singlet Open-Shell Character on the Optically Allowed Singlet Excitation Energy and Singlet–Triplet Energy Gap

(2013) Takuya Minami et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Photochromic Switching of Diradical Character: Design of Efficient Nonlinear Optical Switches

(2013) Katsuki Okuno et al.   Journal of Physical Chemistry Letters

A New Paradigm to Half-Metallicity in Graphene Nanoribbons

(2013) Jin Yu et al.   Journal of Physical Chemistry Letters

Pushing Extended p-Quinodimethanes to the Limit: Stable Tetracyano-oligo(N-annulated perylene)quinodimethanes with Tunable Ground States

(2013) Zebing Zeng et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Dibenzoheptazethrene Isomers with Different Biradical Characters: An Exercise of Clar’s Aromatic Sextet Rule in Singlet Biradicaloids

(2013) Zhe Sun et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Enhancement of the Third-Order Nonlinear Optical Properties in Open-Shell Singlet Transition-Metal Dinuclear Systems: Effects of the Group, of the Period, and of the Charge of the Metal Atom

(2012) Hitoshi Fukui et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Impact of Diradical Character on Two-Photon Absorption: Bis(acridine) Dimers Synthesized from an Allenic Precursor

(2012) Kenji Kamada et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Kinetically Blocked Stable Heptazethrene and Octazethrene: Closed-Shell or Open-Shell in the Ground State?

(2012) Yuan Li et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Stable Tetrabenzo-Chichibabin’s Hydrocarbons: Tunable Ground State and Unusual Transition between Their Closed-Shell and Open-Shell Resonance Forms

(2012) Zebing Zeng et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Open-Shell Characters and Second Hyperpolarizabilities of One-Dimensional Graphene Nanoflakes Composed of Trigonal Graphene Units

(2011) Kyohei Yoneda et al.   CHEMPHYSCHEM

Neutral Radical and Singlet Biradical Forms of Meso-Free, -Keto, and -Diketo Hexaphyrins(1.1.1.1.1.1): Effects on Aromaticity and Photophysical Properties

(2011) Masatoshi Ishida et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Singlet Diradical Character from Experiment

(2010) Kenji Kamada et al.   Journal of Physical Chemistry Letters

Third-order nonlinear optical properties of a π-conjugated biradical molecule investigated by third-harmonic generation spectroscopy

(2010) Hideo Kishida et al.   THIN SOLID FILMS

Remarkable two-photon absorption in open-shell singlet systems

(2009) Edith Botek et al.   JOURNAL OF CHEMICAL PHYSICS

Restricted active space spin-flip configuration interaction approach: theory, implementation and examples

(2009) David Casanova et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Two-photon excited states in charge-transfer type conjugated polymers

(2009) Hideo Kishida et al.   SYNTHETIC METALS

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

Half-Metallicity in Edge-Modified Zigzag Graphene Nanoribbons

(2008) Er-jun Kan et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Field effects on the electronic and spin properties of undoped and doped graphene nanodots

(2008) Huaixiu Zheng et al.   PHYSICAL REVIEW B