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Approximating the total pi-electron energy by means of spectral moments (CROSBI ID 93843)
Prilog u časopisu | izvorni znanstveni rad | međunarodna recenzija
Gutman, Ivan ; Soldatović, Tanja ; Graovac, Ante ; Vuković, Slavko
Approximating the total pi-electron energy by means of spectral moments // Chemical physics letters, 334 (2001), 168-172-x
Podaci o odgovornosti
Gutman, Ivan ; Soldatović, Tanja ; Graovac, Ante ; Vuković, Slavko
engleski
Approximating the total pi-electron energy by means of spectral moments
A new method for approximating the total pi-electron energy (E) of a conjugated hydocarbon by means of spectral moments is put forward. The method results in expressions for E that are non-linear functions of spectral moments.
conjugated hydrocarbons; total pi-electron energy; spectral moments
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