Pure and Applied Chemistry

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• Oziminski W. P., Palusiak M., Dominikowska J., Krygowski T. M., Havenith R. W. A., Gibson C. M., Fowler P. W.: Capturing the elusive aromaticity of bicalicene. Phys. Chem. Chem. Phys. 2013, 15, 3286. <http://dx.doi.org/10.1039/c2cp43426a>
• Aihara Jun-ichi, Sekine Rika, Ishida Toshimasa: Electronic and Magnetic Characteristics of Polycyclic Aromatic Hydrocarbons with Factorizable Kekulé Structure Counts. J Phys Chem A 2011, 115, 9314. <http://dx.doi.org/10.1021/jp205292b>
• Mandado Marcos: Theoretical basis for the correlation between energetic, magnetic, and electron density criteria of aromaticity: definition of molecular circuit electric conductance. Theor Chem Acc 2010, 126, 339. <http://dx.doi.org/10.1007/s00214-009-0692-z>
• Chauvin Remi, Lepetit Christine, Fowler Patrick W., Malrieu Jean-Paul: The chemical roots of the matching polynomial. Phys Chem Chem Phys 2010, 12, 5295. <http://dx.doi.org/10.1039/b923893j>
• Chauvin Remi, Lepetit Christine, Maraval Valérie, Leroyer Léo: Variation of aromaticity by twisting or expanding the ring content. Pure and App Chemis 2010, 1. <http://dx.doi.org/10.1351/PAC-CON-09-11-07>
• Aihara Jun-ichi, Makino Masakazu: Aromaticity and diatropicity of p-polyphenyl-α,ω-quinododimethides. J Math Chem 2009, 46, 108. <http://dx.doi.org/10.1007/s10910-008-9402-7>
• Ishida Toshimasa, Aihara Jun-ichi: Aromaticity of neutral and doubly charged polyacenes. Phys Chem Chem Phys 2009, 11, 7197. <http://dx.doi.org/10.1039/b903815a>
• Aihara Jun-ichi, Makino Masakazu: Aromaticity and Conjugation in Sapphyrin and Orangarin. Bull Chem Soc Jpn 2009, 82, 675. <http://dx.doi.org/10.1246/bcsj.82.675>
• Aihara Jun-ichi, Makino Masakazu: Aromaticity and Diatropicity of Polyacenequinododimethides. Chem Asian J 2008, 3, 585. <http://dx.doi.org/10.1002/asia.200700287>
• Aihara Jun-ichi: Topological resonance energy, bond resonance energy, and circuit resonance energy. J Phys Org Chem 2008, 21, 79. <http://dx.doi.org/10.1002/poc.1291>
• Zubarev Dmitry Yu., Averkiev Boris B., Zhai Hua-Jin, Wang Lai-Sheng, Boldyrev Alexander I.: Aromaticity and antiaromaticity in transition-metal systems. Phys Chem Chem Phys 2008, 10, 257. <http://dx.doi.org/10.1039/b713646c>
• Makino Masakazu, Aihara Jun-ichi: Aromaticity and magnetotropicity of dicyclopenta-fused polyacenes. Phys Chem Chem Phys 2008, 10, 591. <http://dx.doi.org/10.1039/b714906a>
• Aihara Jun-ichi: Dimensionality of Aromaticity. Bull Chem Soc Jpn 2008, 81, 241. <http://dx.doi.org/10.1246/bcsj.81.241>
• Aihara Jun-ichi, Kimura Eiichi, Krygowski Tadeusz Marek: Aromatic Conjugation Pathways in Porphyrins. Bull Chem Soc Jpn 2008, 81, 826. <http://dx.doi.org/10.1246/bcsj.81.826>
• Lee Min-Joo, Aihara Jun-ichi, Kanno Hideaki, Choe Jong-In, Chang Suk-Kyu, Lee Sik, Nanbu Shinkoh: An DFT studies of conformational stability, vibrational frequencies and normal mode analysis of 3-bromo-1-butene. Journal of Molecular Structure: THEOCHEM 2005, 722, 103. <http://dx.doi.org/10.1016/j.theochem.2005.02.004>
• Aihara Jun-ichi: The origin of counter-rotating rim and hub currents in coronene. chem phys letts 2004, 393, 7. <http://dx.doi.org/10.1016/j.cplett.2004.05.122>
• Aihara Jun-ichi: Incorrect NICS-Based Prediction on the Aromaticity of the Pentalene Dication. Bull Chem Soc Jpn 2004, 77, 101. <http://dx.doi.org/10.1246/bcsj.77.101>
• Aihara Jun-ichi: Magnetic Resonance Energy and Aromaticity of Polycyclic Aromatic Hydrocarbon Dianions/Dications. Bull Chem Soc Jpn 2004, 77, 651. <http://dx.doi.org/10.1246/bcsj.77.651>
• OHMAE Takayuki: Transplantation of Topological Resonance Energy Calculation Program from BASIC to Excel/VBA and Practice to Dioxins Toxicity Prediction. J Comput Chem Jpn 2004, 3, 159. <http://dx.doi.org/10.2477/jccj.3.159>
• Aihara Jun-ichi: Hückel-like rule of superaromaticity for charged paracyclophanes. chem phys letts 2003, 381, 147. <http://dx.doi.org/10.1016/j.cplett.2003.09.114>
• Aihara Jun-ichi, Tamaribuchi Tsuguhiro: Verification of the 2(N+1)2 rule for fullerenes. chem phys letts 2003, 374, 104. <http://dx.doi.org/10.1016/S0009-2614(03)00642-0>
• Aihara Jun-ichi: Re-interpretation of the 2(N+1)2 rule for polyhedral closed-shell π-systems. chem phys letts 2003, 375, 571. <http://dx.doi.org/10.1016/S0009-2614(03)00914-X>
• Garcı́a Cuesta I., Soriano Jartı́n R., Sánchez de Merás A., Lazzeretti P.: Current density maps, magnetizability, and nuclear magnetic shielding tensors of bis-heteropentalenes. I. Di-hydro-pyrrolo–pyrrole isomers. J Chem Phys 2003, 119, 5518. <http://dx.doi.org/10.1063/1.1599337>
• Aihara Jun-ichi: Spherical Aromaticity in Fullerenes and the Nucleus-Independent Chemical Shifts at the Cage Centers. Bull Chem Soc Jpn 2003, 76, 103. <http://dx.doi.org/10.1246/bcsj.76.103>
• Aihara Jun-ichi: Nucleus-independent chemical shifts and local aromaticities in large polycyclic aromatic hydrocarbons. chem phys letts 2002, 365, 34. <http://dx.doi.org/10.1016/S0009-2614(02)01415-X>
• Aihara Jun-ichi: Aromatic Character of Large Deltahedral Borane Dianions As Estimated Using the Kettle-Tomlinson Bonding Model. Bull Chem Soc Jpn 2001, 74, 2315. <http://dx.doi.org/10.1246/bcsj.74.2315>
• Wu Jian, Jiang Yuansheng: The valence bond calculations for conjugated hydrocarbons having 24-28 π-electrons. J Comput Chem 2000, 21, 856. <http://dx.doi.org/10.1002/1096-987X(20000730)21:10<856::AID-JCC4>3.0.CO;2-7>
• Ishida T, Oe S, Aihara J, Tanaka Hideki, Zhou Xuefeng, Liu Ruifeng: Raison d'��tre of apparently antiaromatic 1,2-dithiin derivatives in nature. Journal of Molecular Structure: THEOCHEM 1999, 461-462, 553. <http://dx.doi.org/10.1016/S0166-1280(98)00434-5>
• Bird Clive W.: Heteroaromaticity. 12. A group additivity method for the derivation of diamagnetic susceptibility enhancements of aromatic hydrocarbons and azines. Tetrahedron 1998, 54, 9089. <http://dx.doi.org/10.1016/S0040-4020(98)00546-8>
• Bird Clive W.: The relationship of classical and magnetic criteria of aromaticity. Tetrahedron 1996, 52, 9945. <http://dx.doi.org/10.1016/0040-4020(96)00526-1>
• Goeres A., Keller R., Sedlmayr E., Gail H.-P.: Circumstellar Carbon Condensation: I. Low-P, T Stabilities of Polyaromatic Hydrocarbons. Polycyclic Arom Comp 1996, 8, 129. <http://dx.doi.org/10.1080/10406639608048341>
• Kurihara Teruo, Kerim Ablikim, Ishikawa Sumio, Nozoe Tetsuo, Abe Noritaka: Stability and Resonance Energy of Annulated 1-Azaazulenes. Bull Chem Soc Jpn 1993, 66, 1229. <http://dx.doi.org/10.1246/bcsj.66.1229>
• de Smedt Jef, Vanhouteghem Frankie, van Alsenoy Christian, Geise Herman J., Sch��fer Lothar, Sutcliffe Brian T., Klein D.J., Balaban A.T.: Empirical corrections of SCF geometries with special examples from 4-21G calculations. Journal of Molecular Structure: THEOCHEM 1992, 259, 289. <http://dx.doi.org/10.1016/0166-1280(92)87021-Q>
• Kobayashi Keiji, Gajurel Chhabi L., Umemoto Kisaburo, Mazaki Yasuhiro: An Isomeric Series of Thiophene-Fused Tetracyanoquinodimethanes. I. Preparation and Physico-Chemical Properties. Bull Chem Soc Jpn 1992, 65, 2168. <http://dx.doi.org/10.1246/bcsj.65.2168>
• Imamura Akira, Takahashi Kouichi, Murata Shigeo, Sakiyama Minoru: Standard enthalpies of formation of trimethyl cyanurate, malonamide, and 1,3-dimethyluracil. K J CHEM THERMODYN 1989, 21, 237. <http://dx.doi.org/10.1016/0021-9614(89)90013-X>
• Kobayashi Keiji, Pedersen Carl Th., Becher Jan: Sulfur Heterocycles for Organic Conductors and Superconductors. Phosphorus Sulfur Silicon Relat Elem 1989, 43, 187. <http://dx.doi.org/10.1080/10426508908040285>
• Amaral Alberto, Gomes J.A.N.F., Ramos MariaJo��o, Bertran J., Anguiano J., Balaban Alexandru T.: Preface. Journal of Molecular Structure: THEOCHEM 1985, 120, 1. <http://dx.doi.org/10.1016/0166-1280(85)85100-9>
• Yoneda Shigeo, Shibata Mitsuhiro, Kida Shuji, Yoshida Zen-ichi, Kai Yasusi, Miki Kunio, Kasai Nobutami: Ein neuer aromatischer Kohlenwasserstoff mit 16π-Elektronen-Peripherie: „Cyclisches Bicalicen”. Angew Chem 1984, 96, 75. <http://dx.doi.org/10.1002/ange.19840960130>
• Mizoguchi Noriyuki: The circuit rule for the magnetic susceptibility of a polycyclic conjugated system. Chemical Physics Letters 1984, 106, 451. <http://dx.doi.org/10.1016/0009-2614(84)85338-5>