@article {3915,
	title = {Density functional calculations of core-electron binding energies of amines. Application to (CH3)(3)N-Ni and (CH3)(4)N+-Ni},
	journal = {Chemical Physics Letters},
	volume = {264},
	number = {1-2},
	year = {1997},
	note = {ISI Document Delivery No.: WC716Times Cited: 29Cited Reference Count: 20},
	month = {Jan},
	pages = {186-192},
	type = {Article},
	abstract = {A procedure for computing accurate core-electron binding energies via density functional theory is applied to ten molecular systems containing amine and ammonium groups. The procedure uses the unrestricted generalized transition-state model. The method is used on model systems in which amine and ammonium groups interact with a hydroxide or chloride ion, as well as with a nickel atom. The results are used to shed some light on the interpretation of some characteristics of the XPS spectra of pre-electrolysed nickel surfaces used in electropolymerization reactions.},
	keywords = {ACRYLONITRILE, APPROXIMATION, BASIS-SETS, FILMS, MOLECULES, NICKEL, POTENTIALS, SURFACES},
	isbn = {0009-2614},
	url = {<Go to ISI>://A1997WC71600029},
	author = {Bureau, C. and Chong, D. P.}
}
@article {3937,
	title = {Rotational spectra of selected isotopic species of vinyl cyanide: Molecular structure and quadrupole hyperfine structure},
	journal = {Journal of Molecular Spectroscopy},
	volume = {181},
	number = {2},
	year = {1997},
	note = {ISI Document Delivery No.: WH318Times Cited: 11Cited Reference Count: 27},
	month = {Feb},
	pages = {330-344},
	type = {Article},
	abstract = {{The pure rotational spectra of 13 isotopically substituted forms of vinyl cyanide},
	keywords = {ACRYLONITRILE, CENTRIFUGAL-DISTORTION CONSTANTS, MOMENTS, PARAMETERS, SPECTROMETER, SPECTROSCOPY},
	isbn = {0022-2852},
	url = {<Go to ISI>://A1997WH31800010},
	author = {Colmont, J. M. and Wlodarczak, G. and Priem, D. and Muller, H. S. P. and Tien, E. H. and Richards, R. J. and Gerry, M. C. L.}
}
