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  1. The Journal of Molecular Structure is dedicated to the publication of full-length articles and review papers, providing important new structural information on all types of chemical species including: • Polymers. The methods used may include any combination of spectroscopic and non-spectroscopic techniques, for example:

  2. Crystal structures and DFT analysis of Palladium(II) complexes with Schiff bases derived from N,N-dialkyl-p-phenylenediamines

  3. On the molecular and supramolecular properties of N,N′-disubstituted iminoisoindolines: Synthesis, spectroscopy, X-ray structure and Hirshfeld surface analyses, and DFT calculations of two (E)-N,N′-bis(aryl)iminoisoindolines (aryl = 2-tert-butylphenyl or perfluorophenyl)

  4. 10 Μαΐ 2021 · We found that the spin polarization occurs at the first electron transfer step in OER, where coherent spin exchange happens between the ferromagnetic catalyst and the adsorbed oxygen species with...

  5. a r t i c l e i n f o Article (history: N’ Received 23 October 2020 Revised 29 November 2020 Accepted 30 November 2020 Available online 10 December 2020 Keywords: Pyrazole bonds. X-ray DFT NBO AIM Molecular docking a b s t r a c t E )- -pyrazole-3-carbohydrazide -(2,4-dichlorobenzylidene)-5-phenyl- 1H has been(E-DPPC ) synthesized

  6. 10 Ιουν 2016 · Request PDF | On Jun 10, 2016, Ramanaiah Chennuru and others published 50-2016 J Mol Str | Find, read and cite all the research you need on ResearchGate. Data. 50-2016 J Mol Str. June 2016;

  7. 15 Νοε 2018 · We discover that the Fe–Co dual sites embedded in N-doped porous carbon are beneficial for the activation of oxygen by weakening the O O bonds. Herein, we construct a novel electrocatalyst with Fe–Co dual sites embedded in N-doped carbon nanotubes ( (Fe,Co)/CNT), which exhibits inimitable advantages towards the oxygen reduction reaction.

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