| Semi-empirical calculation method for transition metals G Blyholder, J Head, F Ruette Theoretica chimica acta 60, 429-444, 1982 | 90 | 1982 |
| Diatomic molecule data for parametric methods. I F Ruette, M Sánchez, R Anez, A Bermúdez, A Sierraalta Journal of Molecular Structure: THEOCHEM 729 (1-2), 19-37, 2005 | 72 | 2005 |
| Quantum chemistry approaches to chemisorption and heterogeneous catalysis F Ruette Springer Science & Business Media, 2013 | 66 | 2013 |
| Semi-empirical calculation of H atom interaction with a 12 atom iron cluster G Blyholder, J Head, F Ruette Surface science 131 (2-3), 403-418, 1983 | 62 | 1983 |
| Theoretical modeling of molecular interactions of iron with asphaltenes from heavy crude oil S Rosales, I Machín, M Sánchez, G Rivas, F Ruette Journal of Molecular Catalysis A: Chemical 246 (1-2), 146-153, 2006 | 59 | 2006 |
| Chemisorption of atomic H, C, N and O on a cluster-model graphite surface T Fromherz, C Mendoza, F Ruette Monthly Notices of the Royal Astronomical Society 263 (4), 851-860, 1993 | 54 | 1993 |
| Semiempirical calculation of iron-oxygen interactions G Blyholder, J Head, F Ruette Inorganic Chemistry 21 (4), 1539-1545, 1982 | 50 | 1982 |
| Molecular analogs of surface species. 2. A theoretical study of molybdenum carbonyl thiophene complexes: Organometallic models for the chemisorption of thiophene F Ruette, N Valencia, R Sanchez-Delgado Journal of the American Chemical Society 111 (1), 40-46, 1989 | 46 | 1989 |
| Bonding and potential energy curves for NiH and NiH2 F Ruette, G Blyholder, J Head The Journal of chemical physics 80 (5), 2042-2048, 1984 | 39 | 1984 |
| Experimental and theoretical studies of the factors that influence the determination of molybdenum by electrothermal atomic absorption spectroscopy Z Benzo, P Araujo, A Sierraalta, F Ruette Analytical Chemistry 65 (8), 1107-1113, 1993 | 38 | 1993 |
| Quantum-chemical modeling of interstellar grain prebiotic chemistry: Catalytic synthesis of glycine and alanine on the surface of a polycyclic aromatic hydrocarbon flake C Mendoza, F Ruette, G Martorell, LS Rodriguez The Astrophysical Journal 601 (1), L59, 2004 | 36 | 2004 |
| Mo ab initio MCSCF calculation of the charge topology in the H abstraction from CH4 by MgO and LiO molecules Y Aray, J Rodriguez, F Ruette Journal of physical chemistry (1952) 97 (32), 8393-8398, 1993 | 36 | 1993 |
| Molecular orbital calculations of the hydrodesulfurization of thiophene over a Mo Co catalyst F Ruette, EV Ludeña Journal of Catalysis 67 (2), 266-281, 1981 | 36 | 1981 |
| Theoretical study of catalytic steam cracking on a asphaltene model molecule I Machín, JC de Jesús, G Rivas, I Higuerey, J Córdova, P Pereira, ... Journal of Molecular Catalysis A: Chemical 227 (1-2), 223-229, 2005 | 35 | 2005 |
| Cativic: Parametric quantum chemistry package for catalytic reactions: I F Ruette, M Sánchez, G Martorell, C González, R Anez, A Sierraalta, ... International journal of quantum chemistry 96 (4), 321-332, 2004 | 34 | 2004 |
| The importance of global minimization and adequate theoretical tools for cluster optimization: the Ni6 cluster case F Ruette, C González Chemical physics letters 359 (5-6), 428-433, 2002 | 33 | 2002 |
| Pyridine adsorption on a MoS2 modelled surface (Mo3S8). A CNDO molecular orbital study AE Gainza, EN Rodríguez-Arias, F Ruette Journal of molecular catalysis 85 (3), 345-359, 1993 | 32 | 1993 |
| Molecular orbital calculations of the dissociative adsorption of a hydrogen molecule on a 14 atom nickel cluster F Ruette, A Hernández, EV Ludeña Surface Science 151 (1), 103-127, 1985 | 32 | 1985 |
| Analysis of parametric functionals in semiempirical approaches using simulation techniques JR Primera, M Sánchez, M Romero, A Sierraalta, F Ruette Journal of Molecular Structure: THEOCHEM 469 (1-3), 177-190, 1999 | 30 | 1999 |
| Modeling extra framework aluminum (EFAL) formation in the zeolite ZSM-5 using parametric quantum and DFT methods O Lisboa, M Sánchez, F Ruette Journal of Molecular Catalysis A: Chemical 294 (1-2), 93-101, 2008 | 28 | 2008 |
Claudio MendozaEmeritus Research Fellow, IVIC, VenezuelaVerified email at wmich.edu
