Abstract
Equilibrium geometry parameters, total energies, heats of formation, energies of HOMO and LUMO orbitals, and density of one-electron states for some nanotubes Y-junctions of twig types are computed in the frames of semi-empirical quantum chemistry PM3-method. © 2007 Springer.
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CITATION STYLE
APA
Popov, A. P., Bazhin, I. V., & Bogoslavskaya, E. S. (2007). Electronic structure of Y-junctions of carbon nanotubes. In NATO Security through Science Series A: Chemistry and Biology (pp. 801–804). https://doi.org/10.1007/978-1-4020-5514-0_101
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