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Estrin, D. A., Paglieri, L., Corongiu, G., Clementi, E. (1996) Small Clusters of Water Molecules Using Density Functional Theory. The Journal of Physical Chemistry, 100 (21). 8701-8711 doi:10.1021/jp950696w

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Reference TypeJournal (article/letter/editorial)
TitleSmall Clusters of Water Molecules Using Density Functional Theory
JournalThe Journal of Physical Chemistry
AuthorsEstrin, D. A.Author
Paglieri, L.Author
Corongiu, G.Author
Clementi, E.Author
Year1996 (January)Volume100
Issue21
PublisherAmerican Chemical Society (ACS)
DOIdoi:10.1021/jp950696wSearch in ResearchGate
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Mindat Ref. ID8041537Long-form Identifiermindat:1:5:8041537:8
GUID0
Full ReferenceEstrin, D. A., Paglieri, L., Corongiu, G., Clementi, E. (1996) Small Clusters of Water Molecules Using Density Functional Theory. The Journal of Physical Chemistry, 100 (21). 8701-8711 doi:10.1021/jp950696w
Plain TextEstrin, D. A., Paglieri, L., Corongiu, G., Clementi, E. (1996) Small Clusters of Water Molecules Using Density Functional Theory. The Journal of Physical Chemistry, 100 (21). 8701-8711 doi:10.1021/jp950696w
In(1996, January) The Journal of Physical Chemistry Vol. 100 (21) American Chemical Society (ACS)

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Estrin, Dario A., Paglieri, Luca, Corongiu, Giorgina (1994) A Density Functional Study of Tautomerism of Uracil and Cytosine. The Journal of Physical Chemistry, 98 (22). 5653-5660 doi:10.1021/j100073a014
Wang, Jian, Johnson, Benny G., Boyd, Russell J., Eriksson, Leif A. (1996) Electron Densities of Several Small Molecules As Calculated from Density Functional Theory. The Journal of Physical Chemistry, 100 (15). 6317-6324 doi:10.1021/jp952944u
Niesar, U., Corongiu, G., Clementi, E., Kneller, G. R., Bhattacharya, D. K. (1990) Molecular dynamics simulations of liquid water using the NCC ab initio potential. The Journal of Physical Chemistry, 94 (20). 7949-7956 doi:10.1021/j100383a037
Estrin, Darío A., Hamra, O. Yasmine, Paglieri, Luca, Slep, Leonardo D., Olabe, José A. (1996) Structure and Bonding in Pentacyano(L)ferrate(II) and Pentacyano(L)ruthenate(II) Complexes (L = Pyridine, Pyrazine, andN-Methylpyrazinium):  A Density Functional Study. Inorganic Chemistry, 35 (23) 6832-6837 doi:10.1021/ic960534u
Kohn, W., Becke, A. D., Parr, R. G. (1996) Density Functional Theory of Electronic Structure. The Journal of Physical Chemistry, 100 (31). 12974-12980 doi:10.1021/jp960669l
Lie, G. C., Corongiu, G., Clementi, E. (1985) Calculation of the third virial coefficients for water using ab initio two-body and three-body potentials. The Journal of Physical Chemistry, 89 (19). 4131-4134 doi:10.1021/j100265a041
Estrin, Darío A., Baraldo, Luis M., Slep, Leonardo D., Barja, Beatriz C., Olabe, José A., Paglieri, Luca, Corongiu, Giorgina (1996) Theoretical and Experimental Study of Medium Effects on the Structure and Spectroscopy of the [Fe(CN)5NO]2-Ion. Inorganic Chemistry, 35 (13) 3897-3903 doi:10.1021/ic951202c
Wang, Jian, Eriksson, Leif A., Johnson, Benny G., Boyd, Russell J. (1996) Electron Densities of Homonuclear Diatomic Molecules As Calculated from Density Functional Theory. The Journal of Physical Chemistry, 100 (13). 5274-5280 doi:10.1021/jp951023g
Harada, Masafumi, Dexpert, Hervé (1996) Electronic Structure of Transition Metal Clusters from Density Functional Theory. 1. Transition Metal Dimers. The Journal of Physical Chemistry, 100 (2). 565-572 doi:10.1021/jp950910g
Lee, Sang Yeon, Boo, Bong Hyun (1996) Density Functional Theory Study of Vibrational Spectra of Fluorene. The Journal of Physical Chemistry, 100 (21). 8782-8785 doi:10.1021/jp960020g
Nesbet, R. K. (1996) Reference-State Density Functional Theory. The Journal of Physical Chemistry, 100 (15). 6104-6106 doi:10.1021/jp952714f
 
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