Formation of Au-Silane Bonds by Shira Yochelis, Eran Katzir, Yoav Kalcheim, Vitaly Gutkin, Oded Millo, Yossi Paltiel

“…Many intriguing aspects of molecular electronics are attributed to organic-inorganic interactions, yet charge transfer through such junctions still requires fundamental study. …”
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Single Step In Situ Synthesis and Optical Properties of Polyaniline/ZnO Nanocomposites by Deepali Sharma, B. S. Kaith, Jaspreet Rajput

“…The present work focuses on the one-step synthesis and potential use of PANI/ZnO nanocomposite in molecular electronics as well as in optical devices.…”
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Upgrade of a variable temperature scanning tunneling microscope for nanometer-scale spectromicroscopy by B. Cirera, A. Sáez-Coronado, D. Arribas, J. Méndez, A. Sagwal, R. de Campos Ferreira, M. Švec, P. Merino

“…This upgrade opens new possibilities for studying surface chemistry, catalysis, and molecular electronics at state-of-the-art spatial and spectral resolutions using accessible SPM systems. • Portable lens holder • In-situ adjustable position • Nanometer-scale vibrational spectroscopy…”
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Formation on quartz substrate and study of properties of nanostructured layers from polyvinylen obtained by dehydrochlorination of polyvinyl chloride with modifying additive — iron... by O. V. Krivozubov, Yu. G. Kryazhev, I. V. Anikeeva, N. A. Davletkildeev, D. V. Sokolov, O. N. Semenova

“…The resulting data can be used to create an elemental base of molecular electronics.…”
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Nano-shaping of chiral photons by Sunaba Yuji, Ide Masaki, Takei Ryo, Sakai Kyosuke, Pin Christophe, Sasaki Keiji

“…This plasmonic nano-vortex field is expected to fit the molecular electron orbital shape and spin with the corresponding angular momenta.…”
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Novel Thiazole Derivatives of Medicinal Potential: Synthesis and Modeling by Nour E. A. Abdel-Sattar, Abeer M. El-Naggar, M. S. A. Abdel-Mottaleb

“…This paper reports on the synthesis of new thiazole derivatives that could be profitably exploited in medical treatment of tumors. Molecular electronic structures have been modeled within density function theory (DFT) framework. …”
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Synthesis of Some Pyrimidine, Pyrazole, and Pyridine Derivatives and Their Reactivity Descriptors by Nour E. A. Abd El-Sattar, Eman H. K. Badawy, M. S. A. Abdel-Mottaleb

“…The target compounds were synthesized by reaction of compound (1) with urea, thiourea, malononitrile, hydrazine hydrate, and 2,4-dinitrophenyl hydrazine, respectively. Molecular electronic structures have been modeled within density functional theory framework (DFT). …”
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Theoretical Study of the Chemical Properties and the Reaction Pathway of Decarbonylative Alkylative Esterification of Styrenes with Aliphatic Aldehydes by Meysam Madahi, Dadkhoda Ghazanfari, Sayed Ali Ahmadi

“…Chemical properties of styrene and aldehyde derivatives for detecting the stability of products were studied using HOMO and LUMO, potential electronic chemical, global hardness, and global electrophilicity power. The molecular electron potential results show that the styrene and its derivatives are electron donors and aldehyde derivatives are electron acceptors. …”
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Influence of Air Annealing and Gamma Ray Irradiation on the Optical Properties of Cl16FePc Thin Films by Raji Koshy, C. S. Menon

“…In the present work we investigate the optical band gap of the Cl16FePc thin films from the optical absorption spectrum as a function of air annealing temperatures and their suitability for the fabrication of molecular electronic devices. Some optical properties of the samples were studied as a function of γ-radiation doses also. …”
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Effect of Deoxycholic Acid on the Performance of Liquid Electrolyte Dye-Sensitized Solar Cells Using a Perylene Monoimide Derivative by Ganesh D. Sharma, Rajnish Kurchania, Richard J. Ball, Mahesh S. Roy, John A. Mikroyannidis

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Molecular structure, UV–Visible spectra and other molecular properties of (E)-2-(2-hydroxy-5-methoxybenzylidene)hydrazinecarbothioamide and its n-methyl variant by using DFT method... by K. Srishailam, L. Ravindranath, Gaddam. Ramesh, D. Praveena, Sunil kumar V, Danikonda.Suresh Kumar, S. Muthu, G.Ramana Rao

“…Subsequently, we also aim to compute molecular electronic properties such as FMO, NBO, NLO, MESP and Fukui functions to compare them with their corresponding experimental values, wherever available. …”
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