Results 81 to 90 of about 2,216 (186)
Aromaticity‐Dependent Memristive Switching
Advanced Electronic MaterialsIn recent years, memristors have drawn attention as non‐volatile memory devices for advanced computing engineering. The features of memristors, such as hysteresis, high resistance state to low resistance state ratio, retention time, etc., are determined ...
Ewelina Cechosz +5 more
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, 2014 Citation: 'antiaromatic compounds' in the IUPAC Compendium of Chemical Terminology, 3rd ed.; International Union of Pure and Applied Chemistry; 2006. Online version 3.0.1, 2019. 10.1351/goldbook.A00382 • License: The IUPAC Gold Book is licensed under Creative Commons Attribution-ShareAlike CC BY-SA 4.0 International for individual terms.
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On the Aromaticity in Cyclic H‐Bonded Chains: Linking HOMIA Descriptor to Molecular Properties
ChemistrySelect, Volume 11, Issue 5, 5 February 2026.ABSTRACT Aromaticity is a central concept in organic chemistry to explain the high stability of conjugated rings. This study extends this concept to cyclic hydrogen‐bonded (H‐bonded) chains by introducing a modified descriptor, the harmonic oscillator model of intermolecular aromaticity (HOMIA), to quantify aromaticity in cyclic H‐bonded chains of HCN,
Murillo H. Queiroz +3 more
wiley +1 more source
Química NovaA didactic alternative approach is proposed for deducing the molecular orbital topology of acyclic and cyclic polyenes and then evaluating their bonding, antibonding, and nonbonding character.
Silvio Cunha
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Hydrogenation Properties of the TiBx Structures
, 2011 Titanium borates show promissing hydrogen storage characteristics. Structural relaxation around individual hydrogen atoms and the binding energies are studied by means of the density functional theory methods for a number of hydrogenated TiB2, TiB and ...
Makridis, S. S. +6 more
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Perimeter ring currents in benzenoids from Pauling bond orders [PDF]
, 2016 It is shown that the ring currents in perimeter hexagonal rings of Kekulean benzenoids, as estimated within the Randić conjugated-circuit model, can be calculated directly without tedious pairwise comparison of Kekulé structures or Kekulé counting for ...
Bird, W.H. +3 more
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Aromaticity and Antiaromaticity in Zintl Clusters
Chemistry – A European Journal, 2018 AbstractOriginally, the concepts of aromaticity and antiaromaticity were introduced to explain the stability and reactivity of unsaturated organic compounds. Since then, they have been extended to other species with delocalized electrons including various saturated systems, organometallic compounds, and even inorganic clusters and molecules.
Chao Liu +4 more
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Carbon TrendsIn contrast to alternant, in non-alternant nanographenes (NGRs) and graphene nanoribbons (GNRs) no “sublattice structure” can be defined, associated with significant conceptual and computational simplifications. This leads to some fundamental differences
Aristides D. Zdetsis
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Synthesis of Antiaromatic Compounds Utilizing Hyperconjugation and Anionic Charges [PDF]
, 2023 application/pdf【学位授与の要件】中央大学学位規則第4条第1項【論文審査委員主査】石井 洋一（中央大学理工学部教授）【論文審査委員副査】福澤 信一（中央大学理工学部教授）、不破 春彦（中央大学理工学部教授）、佐藤 博彦（中央大学理工学部教授）、斎藤 雅一（埼玉大学大学院理工学研究科教授）departmental bulletin ...
ITO,Shotaro +2 more
core
Molecules, 2018 With their versatile molecular topology and aromaticity, porphyrinoid systems combine remarkable chemistry with interesting photophysical properties and nonlinear optical properties.
Tatiana Woller +4 more
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