Kekulé versus Lewis: When Aromaticity Prevents Electron Pairing and Imposes Polyradical Character

Electron-Transfer Processes in Highly-Correlated Electron Systems of Thiazyl Radicals

(2014) Kunio Awaga et al.   BULLETIN OF THE CHEMICAL SOCIETY OF JAPAN

When a single hole aligns several spins: Double exchange in organic systems

(2014) Georges Trinquier et al.   JOURNAL OF CHEMICAL PHYSICS

Pressure Induced Phase Transitions and Metallization of a Neutral Radical Conductor

(2014) Joanne W. L. Wong et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Hybrid dithiazolothiadiazinyl radicals; versatile building blocks for magnetic and conductive materials

(2013) Stephen M. Winter et al.   CHEMICAL COMMUNICATIONS

Supramolecular architecture, crystal structure and transport properties of the prototypal oxobenzene-bridged bisdithiazolyl radical conductor

(2013) Joanne W. L. Wong et al.   CHEMICAL COMMUNICATIONS

Diradicals

(2013) Manabu Abe   CHEMICAL REVIEWS

Benzenoid Polycyclic Hydrocarbons with an Open-Shell Biradical Ground State

(2013) Zhe Sun et al.   Chemistry-An Asian Journal

The first “Kuhn verdazyl” ligand and comparative studies of its PdCl2 complex with analogous 6-oxoverdazyl ligands

(2013) Cooper W. Johnston et al.   DALTON TRANSACTIONS

Multidimensional Network Structures and Versatile Magnetic Properties of Intermolecular Compounds of a Radical–Anion Ligand, [1,2,5]Thiadiazolo[3,4-f][1,10]phenanthroline 1,1-Dioxide

(2013) Yoshiaki Shuku et al.   INORGANIC CHEMISTRY

Binuclear Ruthenium Complexes of a Neutral Radical Bridging Ligand. A New “Spin” on Mixed Valency

(2013) Stephen D. J. McKinnon et al.   INORGANIC CHEMISTRY

Establishing the Ground State of the Disjoint Diradical Tetramethyleneethane with Quantum Monte Carlo

(2013) Zachary D. Pozun et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

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

One-Electron Oxidation of an Organic Molecule by B(C6F5)3; Isolation and Structures of Stable Non-para-substituted Triarylamine Cation Radical and Bis(triarylamine) Dication Diradicaloid

(2013) Xin Zheng et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

What role has organic chemistry played in the development of molecule-based magnets?

(2013) Hiizu Iwamura   POLYHEDRON

Forty years of Clar's aromatic π-sextet rule

(2013) Miquel Solà   Frontiers in Chemistry

Clar’s Aromatic Sextet and π-Electron Distribution in Nanographene

(2012) Shintato Fujii et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Functionalization of Hexa-peri-hexabenzocoronenes: Investigation of the Substituent Effects on a Superbenzene

(2012) Ryuichi Yamaguchi et al.   Chemistry-An Asian Journal

Elucidation of the Forces Governing the Stereochemistry of Biphenyl

(2012) Jianfeng Jia et al.   EUROPEAN JOURNAL OF ORGANIC CHEMISTRY

A Strategy to Determine Appropriate Active Orbitals and Accurate Magnetic Couplings in Organic Magnetic Systems

(2012) Nicolas Suaud et al.   Journal of Chemical Theory and Computation

Analytical Gradients for Density Functional Calculations with Approximate Spin Projection

(2012) Toru Saito et al.   JOURNAL OF PHYSICAL CHEMISTRY A

A Recipe for Geometry Optimization of Diradicalar Singlet States from Broken-Symmetry Calculations

(2012) Jean-Paul Malrieu et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Crossing the Insulator-to-Metal Barrier with a Thiazyl Radical Conductor

(2012) Aaron Mailman 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

Hexa-peri-hexabenzocoronene in organic electronics

(2012) Helga Seyler et al.   PURE AND APPLIED CHEMISTRY

Designing Magnetic Organic Lattices from High-Spin Polycyclic Units

(2011) Georges Trinquier et al.   CHEMPHYSCHEM

A new spin on bistability

(2011) Robin G. Hicks   Nature Chemistry

Synthetic organic spin chemistry for structurally well-defined open-shell graphene fragments

(2011) Yasushi Morita et al.   Nature Chemistry

Magnetic and conduction properties in 1D organic radical materials: an ab initio inspection for a challenging quest

(2011) Martin Vérot et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

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

(2011) Shuto Motomura et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

The synergy between qualitative theory, quantitative calculations, and direct experiments in understanding, calculating, and measuring the energy differences between the lowest singlet and triplet states of organic diradicals

(2011) W. Carl Lineberger et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

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

(2011) Masayoshi Nakano et al.   THEORETICAL CHEMISTRY ACCOUNTS

Band structures of porous graphenes

(2010) Masashi Hatanaka   CHEMICAL PHYSICS LETTERS

Theoretical Design of High-Spin Polycyclic Hydrocarbons

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

Clar’s Theory, π-Electron Distribution, and Geometry of Graphene Nanoribbons

(2010) Tobias Wassmann et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Hydrogenated graphene nanoribbons for spintronics

(2010) D. Soriano et al.   PHYSICAL REVIEW B

Claromatic Carbon Nanostructures

(2009) Alexandru T. Balaban et al.   Journal of Physical Chemistry C

Organic radicals, a promising route towards original molecule-based magnetic materials

(2008) Cyrille Train et al.   COORDINATION CHEMISTRY REVIEWS

Direct Evaluation of Cyclic Contributions to the π Energy of Conjugated Hydrocarbons from Strongly Localized Zero-Order Pictures†

(2008) Jean-Paul Malrieu et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Aromaticity: an ab Initio Evaluation of the Properly Cyclic Delocalization Energy and the π-Delocalization Energy Distortivity of Benzene

(2008) Celestino Angeli et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Collective magnetic behavior of graphene nanohole superlattices

(2008) Decai Yu et al.   Nano Research

Magnetism and structure at vacant lattice sites in graphene

(2008) M.W.C. Dharma-wardana et al.   PHYSICA E-LOW-DIMENSIONAL SYSTEMS & NANOSTRUCTURES

Molecule-based system with coexisting conductivity and magnetism and without magnetic inorganic ions

(2008) M. M. Matsushita et al.   PHYSICAL REVIEW B

Molecular magnetism, status and perspectives

(2008) Dante Gatteschi et al.   SOLID STATE SCIENCES

Electronic Ground State of Higher Acenes

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