Science requirements and detector concepts for the electron-ion collider: EIC yellow report RA Khalek, A Accardi, J Adam, D Adamiak, W Akers, M Albaladejo, ... Nuclear Physics A 1026, 122447, 2022 | 866 | 2022 |
The ONIOM-PCM method: Combining the hybrid molecular orbital method and the polarizable continuum model for solvation. Application to the geometry and properties of a … T Vreven, B Mennucci, CO da Silva, K Morokuma, J Tomasi The Journal of chemical physics 115 (1), 62-72, 2001 | 256 | 2001 |
Ab Initio Calculations of Absolute pKa Values in Aqueous Solution II. Aliphatic Alcohols, Thiols, and Halogenated Carboxylic Acids CO Silva, EC da Silva, MAC Nascimento The Journal of Physical Chemistry A 104 (11), 2402-2409, 2000 | 188 | 2000 |
Ab Initio Calculations of Absolute pKa Values in Aqueous Solution I. Carboxylic Acids CO da Silva, EC da Silva, MAC Nascimento The Journal of Physical Chemistry A 103 (50), 11194-11199, 1999 | 182 | 1999 |
A theoretical study of glucose mutarotation in aqueous solution AM Silva, EC da Silva, CO da Silva Carbohydrate research 341 (8), 1029-1040, 2006 | 102 | 2006 |
Density functional study of the optical rotation of glucose in aqueous solution CO da Silva, B Mennucci, T Vreven The Journal of Organic Chemistry 69 (23), 8161-8164, 2004 | 70 | 2004 |
The anomeric effect: the dominance of exchange effects in closed-shell systems GF Bauerfeldt, TM Cardozo, MS Pereira, CO da Silva Organic & Biomolecular Chemistry 11 (2), 299-308, 2013 | 58 | 2013 |
Refinements on solvation continuum models: Hydrogen-bond effects on the OH stretch in liquid water and methanol C Cappelli, B Mennucci, CO da Silva, J Tomasi The Journal of Chemical Physics 112 (12), 5382-5392, 2000 | 53 | 2000 |
Análise de alimentos JC GOMES, MHL Silva, CO SILVA UFV, Viçosa, Brazil, 1996 | 52 | 1996 |
Classificação climática do Estado do Piauí AS Andrade Júnior, EA Bastos, AHC Barros, CO Silva, AAN Gomes Teresina: Embrapa Meio-Norte, 2004 | 51 | 2004 |
Study of the Stepwise Deprotonation Reactions of Glyphosate and the Corresponding pKa Values in Aqueous Solution MM Peixoto, GF Bauerfeldt, MH Herbst, MS Pereira, CO da Silva The Journal of Physical Chemistry A 119 (21), 5241-5249, 2015 | 48 | 2015 |
Polarimetry as a Tool for the Study of Solutions of Chiral Solutes AV Orlova, RR Andrade, CO da Silva, AI Zinin, LO Kononov ChemPhysChem 15 (1), 195-207, 2014 | 45 | 2014 |
Ab initio conformational maps for disaccharides in gas phase and aqueous solution CO da Silva, MAC Nascimento Carbohydrate research 339 (1), 113-122, 2004 | 38 | 2004 |
Combining microsolvation and polarizable continuum studies: New insights in the rotation mechanism of amides in water CO da Silva, B Mennucci, T Vreven The Journal of Physical Chemistry A 107 (34), 6630-6637, 2003 | 35 | 2003 |
On the generalized valence bond description of the anomeric and exo-anomeric effects: an ab initio conformational study of 2-methoxytetrahydropyran RS Bitzer, AGH Barbosa, CO da Silva, MAC Nascimento Carbohydrate research 340 (13), 2171-2184, 2005 | 34 | 2005 |
Solvent effects on vibrational modes: ab-initio calculations, scaling and solvent functions with applications to the carbonyl stretch of dialkyl ketones C Cappelli, CO Silva, J Tomasi Journal of Molecular Structure: THEOCHEM 544 (1-3), 191-203, 2001 | 27 | 2001 |
Pullout bond strength of fiber posts luted to different depths and submitted to artificial aging VC Macedo, NAY Souza, ALF Silva, C Cotes, C da Silva, M Martinelli, ... Operative dentistry 38 (4), E128-E133, 2013 | 25 | 2013 |
Theoretical characterization of the ground state of the alkaline‐earth monocarbides: Ordering of the two lower‐lying states of the BeC, MgC, and CaC molecules CO Da Silva, FEC Teixeira, JAT Azevedo, EC Da Silva, MAC Nascimento International journal of quantum chemistry 60 (1), 433-438, 1996 | 23 | 1996 |
Carbohydrates and quantum chemistry: how useful is this combination? CO Silva Theoretical Chemistry Accounts 116, 137-147, 2006 | 22 | 2006 |
Perfil sociodemográfico e clínico de crianças com estomia atendidas em um serviço de referência, Belém (PA). P Dias Bezerra, IS Martins Pinto, R Ribeiro Cunha, ... Revista Estima 15 (4), 2017 | 20 | 2017 |