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Miquel Solà

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2009
15EEAlbert Poater, Ana Gallegos Saliner, Ramon Carbó-Dorca, Jordi Poater, Miquel Solà, Luigi Cavallo, Andrew P. Worth: Modeling the structure-property relationships of nanoneedles: A journey toward nanomedicine. Journal of Computational Chemistry 30(2): 275-284 (2009)
2008
14EEFerran Feixas, Eduard Matito, Jordi Poater, Miquel Solà: On the performance of some aromaticity indices: A critical assessment using a test set. Journal of Computational Chemistry 29(10): 1543-1554 (2008)
13EEMiquel Torrent-Sucarrat, Pedro Salvador, Miquel Solà, Paul Geerlings: The hardness kernel as the basis for global and local reactivity indices. Journal of Computational Chemistry 29(7): 1064-1072 (2008)
2007
12EEF. Matthias Bickelhaupt, Miquel Solà, Célia Fonseca Guerra: Covalent versus ionic bonding in alkalimetal fluoride oligomers. Journal of Computational Chemistry 28(1): 238-250 (2007)
11EEMiquel Torrent-Sucarrat, Pedro Salvador, Paul Geerlings, Miquel Solà: On the quality of the hardness kernel and the Fukui function to evaluate the global hardness. Journal of Computational Chemistry 28(2): 574-583 (2007)
10EEMarcel Swart, Miquel Solà, F. Matthias Bickelhaupt: Energy landscapes of nucleophilic substitution reactions: A comparison of density functional theory and coupled cluster methods. Journal of Computational Chemistry 28(9): 1551-1560 (2007)
2005
9EEG. Theodoor De Jong, Daan P. Geerke, Axel Diefenbach, Miquel Solà, F. Matthias Bickelhaupt: Oxidative addition of the ethane C-C bond to Pd. An ab initio benchmark and DFT validation study. Journal of Computational Chemistry 26(10): 1006-1020 (2005)
8EEA. Patrícia Bento, Miquel Solà, F. Matthias Bickelhaupt: Ab initio and DFT benchmark study for nucleophilic substitution at carbon (SN2@C) and silicon (SN2@Si). Journal of Computational Chemistry 26(14): 1497-1504 (2005)
2004
7EEXavier Fradera, Miquel Solà: Second-order atomic Fukui indices from the electron-pair density in the framework of the atoms in molecules theory. Journal of Computational Chemistry 25(3): 439-446 (2004)
2002
6EEXavier Fradera, Miquel Solà: Electron localization and delocalization in open-shell molecules. Journal of Computational Chemistry 23(14): 1347-1356 (2002)
2001
5EEJordi Poater, Miquel Duran, Miquel Solà: Parametrization of the Becke3-LYP hybrid functional for a series of small molecules using quantum molecular similarity techniques. Journal of Computational Chemistry 22(14): 1666-1678 (2001)
2000
4EEMarta Forés, Miquel Duran, Miquel Solà, Ludwik Adamowicz: Theoretical characterization of intramolecular proton transfer in the ground and the lowest-lying triplet excited states of 1-amino-3-propenal: a methodological comparison. Journal of Computational Chemistry 21(4): 257-269 (2000)
1995
3 F. Matthias Bickelhaupt, Miquel Solà, Paul von Ragué Schleyer: Theoretical Investigation of the Relative Stabilites of XSSX and X2SS Isomers (X=F, C1, H, and CH3. Journal of Computational Chemistry 16(4): 465-477 (1995)
1994
2EEMiquel Solà, Jordi Mestres, Miquel Duran, Ramon Carbó: Ab Initio Quantum Molecular Similarity Measures on Metal-Substituted Carbonic Anhydrase (MIICA, M = Be, Mg, Mn, Co, Ni, Cu, Zn, and Cd). Journal of Chemical Information and Computer Sciences 34(5): 1047-1053 (1994)
1 Jordi Mestres, Miquel Solà, Miquel Duran, Ramon Carbó: On the Calculation of Ab Initio Quantum Molecular Similarities for Large Systems: Fitting the Electron Density. Journal of Computational Chemistry 15(10): 1113-1120 (1994)

Coauthor Index

1Ludwik Adamowicz [4]
2A. Patrícia Bento [8]
3F. Matthias Bickelhaupt [3] [8] [9] [10] [12]
4Ramon Carbó-Dorca (Ramon Carbó) [1] [2] [15]
5Luigi Cavallo [15]
6Axel Diefenbach [9]
7Miquel Duran [1] [2] [4] [5]
8Ferran Feixas [14]
9Marta Forés [4]
10Xavier Fradera [6] [7]
11Daan P. Geerke [9]
12Paul Geerlings [11] [13]
13Célia Fonseca Guerra [12]
14G. Theodoor De Jong [9]
15Eduard Matito [14]
16Jordi Mestres [1] [2]
17Albert Poater [15]
18Jordi Poater [5] [14] [15]
19Ana Gallegos Saliner (Ana Gallegos) [15]
20Pedro Salvador [11] [13]
21Paul von Ragué Schleyer [3]
22Marcel Swart [10]
23Miquel Torrent-Sucarrat [11] [13]
24Andrew P. Worth [15]

Colors in the list of coauthors

Copyright © Sun May 17 03:24:02 2009 by Michael Ley (ley@uni-trier.de)