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Gavezzotti, A., Simonetta, M. (1982) Force-field calculations on the structure and energy of azulene layers Pt(III). Chemical Physics Letters, 92. 16-18 doi:10.1016/0009-2614(82)83404-0

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Reference TypeJournal (article/letter/editorial)
TitleForce-field calculations on the structure and energy of azulene layers Pt(III)
JournalChemical Physics Letters
AuthorsGavezzotti, A.Author
Simonetta, M.Author
Year1982 (October)Volume92
PublisherElsevier BV
DOIdoi:10.1016/0009-2614(82)83404-0Search in ResearchGate
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Mindat Ref. ID5873252Long-form Identifiermindat:1:5:5873252:0
GUID0
Full ReferenceGavezzotti, A., Simonetta, M. (1982) Force-field calculations on the structure and energy of azulene layers Pt(III). Chemical Physics Letters, 92. 16-18 doi:10.1016/0009-2614(82)83404-0
Plain TextGavezzotti, A., Simonetta, M. (1982) Force-field calculations on the structure and energy of azulene layers Pt(III). Chemical Physics Letters, 92. 16-18 doi:10.1016/0009-2614(82)83404-0
In(n.d.) Chemical Physics Letters Vol. 92. Elsevier BV

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Gavezzotti, A., Ortoleva, E., Simonetta, M. (1983) Naphthalene and azulene adsorption on Pt(111). Extended Hückel calculations. Chemical Physics Letters, 98. 536-540 doi:10.1016/0009-2614(83)80236-x
Gavezzotti, A., Simonetta, M. (1982) Determination of the orientation of naphthalene molecules on Pt(111) by packing energy calculations. Surface Science Letters, 116 (2). doi:10.1016/0167-2584(82)90168-2
Gavezzotti, A., Tantardini, G.F., Simonetta, M. (1986) Molecular-orbital calculations on Pt2, PtH and PtCO with an optimized relativistic pseudopotential for Pt. Chemical Physics Letters, 129. 577-581 doi:10.1016/0009-2614(86)80403-1
Gavezzotti, Angelo, Simonetta, Massimo (1977) Extended Hückel study of the chemisorption of acetylene on the Pt(III) surface. Chemical Physics Letters, 48. 434-438 doi:10.1016/0009-2614(77)85062-8
Gavezzotti, A., Simonetta, M. (1982) Determination of the orientation of naphthalene molecules on Pt(111) by packing energy calculations. Surface Science, 116 (2). doi:10.1016/0039-6028(82)90423-x
Gavezzotti, Angelo, Simonetta, Massimo (1979) EHT study of the dissociative chemisorption of acetylene on the Pt(111) surface. Chemical Physics Letters, 61. 435-440 doi:10.1016/0009-2614(79)87144-4
Filippini, G., Gavezzotti, A. (1994) The crystal structure of 1,3,5-triammo-2,4,6-trimtrobenzene. Chemical Physics Letters, 231. 86-92 doi:10.1016/0009-2614(94)01218-0
Gavezzotti, A., Simonetta, M. (1983) On the generation of trial structures and the evaluation of the formation energy for layers of chemisorbed molecules on metal surfaces: Naphthalene and azulene on Rh(111). Surface Science Letters, 134 (3). doi:10.1016/0167-2584(83)90637-0
Tantardini, Gian Franco, Simonetta, Massimo (1982) Quasi-classical trajectories study of the chemisorption of H2 on the Pt(111) surface: effect of surface motion. Chemical Physics Letters, 87. 420-425 doi:10.1016/0009-2614(82)83003-0
Gutsev, G.L., Boldyrev, A.I. (1982) DVM Xα calculations on the electronic structure of “superalkali” cations. Chemical Physics Letters, 92. 262-266 doi:10.1016/0009-2614(82)80272-8
Simonetta, M., Gavezzotti, A. (1984) Extended Huckel and empirical force field calculations for chemisorption on metal surfaces. Journal of Molecular Structure: THEOCHEM, 107. 75-86 doi:10.1016/0166-1280(84)80039-1
 
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