Second hyperpolarizability (γ) of singlet diradical system: dependence of γ on the diradical character M Nakano, R Kishi, T Nitta, T Kubo, K Nakasuji, K Kamada, K Ohta, ... The Journal of Physical Chemistry A 109 (5), 885-891, 2005 | 349 | 2005 |
Synthesis and characterization of teranthene: a singlet biradical polycyclic aromatic hydrocarbon having Kekulé structures A Konishi, Y Hirao, M Nakano, A Shimizu, E Botek, B Champagne, ... Journal of the American Chemical Society 132 (32), 11021-11023, 2010 | 309 | 2010 |
Relationship between third-order nonlinear optical properties and magnetic interactions in open-shell systems: a new paradigm for nonlinear optics M Nakano, R Kishi, S Ohta, H Takahashi, T Kubo, K Kamada, K Ohta, ... Physical review letters 99 (3), 033001, 2007 | 291 | 2007 |
Singlet diradical character from experiment K Kamada, K Ohta, A Shimizu, T Kubo, R Kishi, H Takahashi, E Botek, ... The Journal of Physical Chemistry Letters 1 (6), 937-940, 2010 | 207 | 2010 |
Basis set and electron correlation effects on the polarizability and second hyperpolarizability of model open-shell π-conjugated systems B Champagne, E Botek, M Nakano, T Nitta, K Yamaguchi The Journal of chemical physics 122 (11), 2005 | 159 | 2005 |
(Hyper) polarizability density analysis for open-shell molecular systems based on natural orbitals and occupation numbers M Nakano, H Fukui, T Minami, K Yoneda, Y Shigeta, R Kishi, ... Theoretical Chemistry Accounts 130, 711-724, 2011 | 129 | 2011 |
Second hyperpolarizabilities (γ) of bisimidazole and bistriazole benzenes: diradical character, charged state, and spin state dependences M Nakano, R Kishi, N Nakagawa, S Ohta, H Takahashi, S Furukawa, ... The Journal of Physical Chemistry A 110 (12), 4238-4243, 2006 | 120 | 2006 |
Theoretical study of third-order nonlinear optical properties in square nanographenes with open-shell singlet ground states M Nakano, H Nagai, H Fukui, K Yoneda, R Kishi, H Takahashi, A Shimizu, ... Chemical Physics Letters 467 (1-3), 120-125, 2008 | 118 | 2008 |
Theoretical and experimental investigation of electric field induced second harmonic generation in tetrathia [7] helicenes A Bossi, E Licandro, S Maiorana, C Rigamonti, S Righetto, ... The Journal of Physical Chemistry C 112 (21), 7900-7907, 2008 | 114 | 2008 |
Signature of multiradical character in second hyperpolarizabilities of rectangular graphene nanoflakes H Nagai, M Nakano, K Yoneda, R Kishi, H Takahashi, A Shimizu, T Kubo, ... Chemical Physics Letters 489 (4-6), 212-218, 2010 | 107 | 2010 |
Origin of the enhancement of the second hyperpolarizability of singlet diradical systems with intermediate diradical character M Nakano, R Kishi, S Ohta, A Takebe, H Takahashi, S Furukawa, T Kubo, ... The Journal of chemical physics 125 (7), 2006 | 107 | 2006 |
Spin multiplicity effects on the second hyperpolarizability of an open-shell neutral π-conjugated system M Nakano, T Nitta, K Yamaguchi, B Champagne, E Botek The Journal of Physical Chemistry A 108 (18), 4105-4111, 2004 | 105 | 2004 |
Long-range corrected density functional theory study on static second hyperpolarizabilities of singlet diradical systems R Kishi, S Bonness, K Yoneda, H Takahashi, M Nakano, E Botek, ... The Journal of chemical physics 132 (9), 2010 | 102 | 2010 |
Theoretical study on the second hyperpolarizabilities of phenalenyl radical systems involving acetylene and vinylene linkers: diradical character and spin multiplicity dependences S Ohta, M Nakano, T Kubo, K Kamada, K Ohta, R Kishi, N Nakagawa, ... The Journal of Physical Chemistry A 111 (18), 3633-3641, 2007 | 102 | 2007 |
Theoretical study of the second-order nonlinear optical properties of [N] helicenes and [N] phenylenes E Botek, B Champagne, M Turki, JM André The Journal of chemical physics 120 (4), 2042-2048, 2004 | 99 | 2004 |
Theoretical study of the two-photon absorption properties of several asymmetrically substituted stilbenoid molecules K Ohta, L Antonov, S Yamada, K Kamada The Journal of chemical physics 127 (8), 2007 | 90 | 2007 |
Theoretical study on third-order nonlinear optical properties in hexagonal graphene nanoflakes: Edge shape effect H Nagai, M Nakano, K Yoneda, H Fukui, T Minami, S Bonness, R Kishi, ... Chemical Physics Letters 477 (4-6), 355-359, 2009 | 88 | 2009 |
Second-harmonic generation in GFP-like proteins I Asselberghs, C Flors, L Ferrighi, E Botek, B Champagne, H Mizuno, ... Journal of the American Chemical Society 130 (46), 15713-15719, 2008 | 76 | 2008 |
Second hyperpolarizability of zethrenes M Nakano, B Champagne, T Kubo, H Takahashi, A Takebe, M Nate, ... Computing Letters 3 (2), 333-338, 2007 | 74 | 2007 |
Theoretical design of substituted tetrathia-[7]-helicenes with large second-order nonlinear optical responses B Champagne, JM André, E Botek, E Licandro, S Maiorana, A Bossi, ... ChemPhysChem 5 (9), 1438-1442, 2004 | 62 | 2004 |