Calculations on the singlet-triplet ener
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O.P. Strausz; M.A. Robb; G. Theodorakopoulos; P.G. Mezey; I.G. Csizmadia
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Article
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1977
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Elsevier Science
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English
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The total energy and the conformationol hypetsutfacc of the lowest singlet and triplet states of sðylene, C.!2SiH2 have been studied using ab initio SCF MO calculations with unrestricted and restricted Hartree-Fock methods, A minimal and an extended basis set was employed. The ground state is pre