검색결과 : 42건
| No. | Article |
|---|---|
| 1 |
ONIOM Investigation of the Second-Order Nonlinear Optical Responses of Fluorescent Proteins de Wergifosse M, Botek E, De Meulenaere E, Clays K, Champagne B Journal of Physical Chemistry B, 122(19), 4993, 2018 |
| 2 |
In situ nitroxide-mediated polymerization of styrene promoted by the N-tert-butyl--isopropylnitrone/bpo pair: ESR investigations Detrembleur C, Clement JL, Sciannamea V, Jerome C, Catala JM, Gigmes D, Autissier L, Botek E, Zarycz N, Champagne B Journal of Polymer Science Part A: Polymer Chemistry, 51(8), 1786, 2013 |
| 3 |
Enhancement of Second Hyperpolarizabilities in Open-Shell Singlet Slipped-Stack Dimers Composed of Square Planar Nickel Complexes Involving o-Semiquinonato Type Ligands Fukui H, Shigeta Y, Nakano M, Kubo T, Kamada K, Ohta K, Champagne B, Botek E Journal of Physical Chemistry A, 115(6), 1117, 2011 |
| 4 |
Fingerprints for Structural Defects in Poly(thienylene vinylene) (PTV): A Joint Theoretical-Experimental NMR Study on Model Molecules Dilien H, Marin L, Botek E, Champagne B, Lemaur V, Beljonne D, Lazzaroni R, Cleij TJ, Maes W, Lutsen L, Vanderzande D, Adriaensens PJ Journal of Physical Chemistry B, 115(42), 12040, 2011 |
| 5 |
Electrostatic modeling of the linear optical susceptibilities of 2-methyl-4-nitroaniline, m-nitroaniline, 3-methyl-4-nitropyridine N-oxide and 2-carboxylic acid-4-nitropyridine-1-oxide crystals Kanoun MB, Botek E, Champagne B Chemical Physics Letters, 487(4-6), 256, 2010 |
| 6 |
Signature of multiradical character in second hyperpolarizabilities of rectangular graphene nanoflakes Nagai H, Nakano M, Yoneda K, Kishi R, Takahashi H, Shimizu A, Kubo T, Kamada K, Ohta K, Botek E, Champagne B Chemical Physics Letters, 489(4-6), 212, 2010 |
| 7 |
Theoretical investigation on the second hyperpolarizabilities of open-shell singlet systems by spin-unrestricted density functional theory with long-range correction: Range separating parameter dependence Bonness S, Fukui H, Yoneda K, Kishi R, Champagne B, Botek E, Nakano M Chemical Physics Letters, 493(1-3), 195, 2010 |
| 8 |
Approximate spin-projected spin-unrestricted density functional theory method: Application to the diradical character dependences of the (hyper) polarizabilities in p-quinodimethane models Nakano M, Minami T, Fukui H, Yoneda K, Shigeta Y, Kishi R, Champagne B, Botek E Chemical Physics Letters, 501(1-3), 140, 2010 |
| 9 |
Synthesis and Characterization of Teranthene: A Singlet Biradical Polycyclic Aromatic Hydrocarbon Having Kekule Structures Konishi A, Hirao Y, Nakano M, Shimizu A, Botek E, Champagne B, Shiomi D, Sato K, Takui T, Matsumoto K, Kurata H, Kubo T Journal of the American Chemical Society, 132(32), 11021, 2010 |
| 10 |
Electron donor solvent effects on the (hyper)polarizabilities of a singlet diradical molecule involving a boron atom Kubota K, Takahashi H, Fukui H, Bonness S, Yoneda K, Kishi R, Kubo T, Kamada K, Ohta K, Champagne B, Botek E, Nakano M Chemical Physics Letters, 477(4-6), 309, 2009 |