Energy relations between small and large unit cell boron–nitrogen polymer analogues of spiral graphite and nanoneedle structures |
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| Authors: | Paul G Mezey |
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| Institution: | (1) Scientific Modeling and Simulation, Departments of Chemistry, Physics, and Physical Oceanography, Memorial University of Newfoundland, 283 Prince Philip Drive, St. John’s, NL, Canada, A1B 3X7;(2) Collegium Budapest, Institute for Advanced Study, Szentháromság u. 2, 1014 Budapest, Hungary |
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| Abstract: | Based on a comparison of nuclear charges combined with a convexity property of Hamiltonians, and employing nuclear charge
transformations representing a limited case of the Universal Molecule Model, simple electronic energy relations are obtained
for the unit cells of polymeric boron–nitrogen analogues of carbon-based nanoneedles and spiral graphite structures. |
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| Keywords: | Unit cell relations Universal molecule model Spiral graphite Nanoneedles |
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