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Molecular Physics
An International Journal at the Interface Between Chemistry and Physics
Volume 112, 2014 - Issue 7
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Research Article

DFT and DFT-D studies on molecular structure of double-decker phthalocyaninato-terbium(III) complex

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Pages 995-1001 | Received 02 May 2013, Accepted 10 Jul 2013, Published online: 13 Aug 2013

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Aide Wang, Jinde Cui, Linhan Zhang, Lili Liang, Yuncan Cao & Qingrun Liu. (2023) Monitoring of COS, SO2, H2S, and CS2 gases by Al24P24 nanoclusters: a DFT inspection. Journal of Molecular Modeling 29:4.
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Alexander G. Martynov, Marina A. Polovkova, Yulia G. Gorbunova & Aslan Yu. Tsivadze. (2022) Redox-Triggered Switching of Conformational State in Triple-Decker Lanthanide Phthalocyaninates. Molecules 27:19, pages 6498.
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Song Ding & Wei Gu. (2022) Evaluate the potential utilization of B24N24 fullerene in the recognition of COS, H2S, SO2, and CS2 gases (environmental pollution). Journal of Molecular Liquids 345, pages 117041.
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Takaumi Morita, Marko Damjanović, Keiichi Katoh, Yasutaka Kitagawa, Nobuhiro Yasuda, Yanhua Lan, Wolfgang Wernsdorfer, Brian K. Breedlove, Markus Enders & Masahiro Yamashita. (2018) Comparison of the Magnetic Anisotropy and Spin Relaxation Phenomenon of Dinuclear Terbium(III) Phthalocyaninato Single-Molecule Magnets Using the Geometric Spin Arrangement. Journal of the American Chemical Society 140:8, pages 2995-3007.
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Zhifu Liang, Marko Damjanović, Mritunjoy Kamila, Goulven Cosquer, Brian K. Breedlove, Markus Enders & Masahiro Yamashita. (2017) Proton Control of the Lanthanoid Single-Ion Magnet Behavior of a Double-Decker Complex with an Indolenine-Substituted Annulene Ligand. Inorganic Chemistry 56:11, pages 6512-6521.
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Marko Damjanović, Yusuke Horie, Takaumi Morita, Yoji Horii, Keiichi Katoh, Masahiro Yamashita & Markus Enders. (2015) α-Substituted Bis(octabutoxyphthalocyaninato)Terbium(III) Double-Decker Complexes: Preparation and Study of Protonation by NMR and DFT. Inorganic Chemistry 54:24, pages 11986-11992.
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Marko Damjanović, Takaumi Morita, Keiichi Katoh, Masahiro Yamashita & Markus Enders. (2015) Ligand π-Radical Interaction with f-Shell Unpaired Electrons in Phthalocyaninato-Lanthanoid Single-Molecule Magnets: A Solution NMR Spectroscopic and DFT Study. Chemistry - A European Journal 21:41, pages 14421-14432.
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Stefan Müllegger, Stefano Tebi, Amal K. Das, Wolfgang Schöfberger, Felix Faschinger & Reinhold Koch. (2014) Radio Frequency Scanning Tunneling Spectroscopy for Single-Molecule Spin Resonance. Physical Review Letters 113:13.
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