Multimolecular polyhedra and QSPR

DOI10.1007/s10910-014-0351-zzbMath1296.92239OpenAlexW1980963421WikidataQ62511095 ScholiaQ62511095MaRDI QIDQ460944

Ramon Carbó-Dorca

Publication date: 9 October 2014

Published in: Journal of Mathematical Chemistry (Search for Journal in Brave)

Full work available at URL: https://doi.org/10.1007/s10910-014-0351-z

zbMATH Keywords

density functionsMP origin shiftsmultimolecular polyhedraQSPR operatorsquantum MPquantum object setsquantum QSPRtagged sets

Mathematics Subject Classification ID

Molecular structure (graph-theoretic methods, methods of differential topology, etc.) (92E10)

Related Items (11)

A study on the centroid vector of a polyhedron ⋮ \(N\)-dimensional Boolean hypercubes and the Goldbach conjecture ⋮ On the nature of the collective quantum mechanical description of molecular atoms and bonds ⋮ Universal transformation and non-linear connection between experimental and calculated property vectors in QSPR ⋮ A quantum similarity discussion about Einstein-Podolsky-Rosen (EPR) paradox in Gaussian enfolded spaces ⋮ Least squares estimation of unknown molecular properties and quantum QSPR fundamental equation ⋮ An isometric representation problem in quantum multimolecular polyhedra and similarity ⋮ An isometric representation problem in quantum multimolecular polyhedra and similarity: II: Synisometry ⋮ A theorem on the Gram matrix of a polyhedron ⋮ Quantum polyhedra, definitions, statistics and the construction of a collective quantum similarity index ⋮ Hypercubes defined on \(n\)-ary sets, the Erdös-Faber-Lovász conjecture on graph coloring, and the description spaces of polypeptides and RNA

Cites Work

• Shells, point cloud huts, generalized scalar products, cosines and similarity tensor representations in vector semispaces
• Centroid origin shift of quantum object sets and molecular point clouds description and element comparisons
• Mathematical aspects of the LCAO MO first order density function. V: Centroid shifting of MO shape functions basis set, properties and applications
• Variational principle, Hohenberg-Kohn theorem, and density function origin shifts

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