Browsing Makale Koleksiyonu by Author "Atalay, Y; Sancak, K; Avci, D;"

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Computational note on theoretical studies of ethene-1,1,2,2-tetrayltetramethylene tetrathiocyanate

Atalay, Yusuf; Avcı, Davut (ELSEVIER SCIENCE BV, 2006)

The molecular geometry and vibrational frequencies of the title (C10H8N4S4) compound in the ground state have been calculated using the Hartree-Fock (HF) and density functional method (B3LYP) with 6-31 G(d) basis set. ...