Jorge Manuel Campos Marques
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Data da última atualização
»Last update
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08/01/2014 |
Dados pessoais (Personal data)
Nome completo
Full name |
Jorge Manuel Campos Marques |
Nome em citações bibliográficas
Quoting name |
Marques, Jorge Manuel Campos |
Categoria profissional
Position |
Professor Auxiliar |
Domínio científico de atuação
Scientific domain |
Ciências Exactas-Química.
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Sexo
Gender |
Masculino»Male |
Graus Académicos
(Academic Degrees)
1991-1995 |
Doutoramento Phd |
Química Teórica
(4 anos » years)
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Universidade de Coimbra,
Portugal.
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1987-1991 |
Licenciatura Licentiate degree |
Química
(4 anos » years)
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Universidade de Coimbra,
Portugal.
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Vínculos profissionais
(Professional Positions)
Abr/1995-Actual |
Professor Auxiliar |
Línguas (Languages)
Compreende Understandig |
Português (Bem), Inglês (Bem), Francês (Bem), Espanhol (Bem), Italiano (Razoavelmente). |
Fala Speaking |
Português (Bem), Inglês (Bem), Francês (Razoavelmente), Espanhol (Razoavelmente), Italiano (Pouco). |
Lê Reading |
Português (Bem), Inglês (Bem), Francês (Bem), Espanhol (Razoavelmente), Italiano (Razoavelmente). |
Escreve Writing |
Português (Bem), Inglês (Bem), Francês (Bem), Espanhol (Pouco), Italiano (Pouco). |
Membro de Associações Profissionais/Científicas (Professional/Scientific Association membership)
Actual |
Sociedade Portuguesa de Química, Membro.
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Produção científica, técnica e artística/cultural
(Scientific, technical and artistical/cultural
production)
Capítulos de livros publicados Published book chapters |
1. |
Pereira, F. B; Marques, J. M. C; Leitao, T.; Tavares, J.. 2008. Advances in Metaheuristics for Hard Optimization. In Advances in Metaheuristics for Hard Optimization, 223 - 250. . .: Spinger-Verlag. |
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Artigos em revistas com arbitragem científica Papers in periodics with scientific refereeing |
1. |
Marques, Jorge M. C; Pereira, Francisco B. 2013. "A detailed investigation on the global minimum structures of mixed rare-gas clusters: Geometry, energetics, and site occupancy", Journal of Computational Chemistry 34, 6: 505 - 517.
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2. |
Marques, J. M. C; Llanio-Trujillo, J. L; Alberti, M.; Aguilar, A.; Pirani, F.. 2012. "Alkali-Ion Microsolvation with Benzene Molecules", Journal of Physical Chemistry A 116, 20: 4947 - 4956.
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3. |
Marques, J. M. C; Pais, A. A. C. C; Abreu, P. E. 2012. "On the use of big-bang method to generate low-energy structures of atomic clusters modeled with pair potentials of different
ranges", Journal of Computational Chemistry 33, 4: 442 - 452.
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4. |
Nogueira, Juan J; Sánchez-Coronilla, Antonio; Marques, Jorge M; Hase, William L; Martínez-Núñez, Emilio; Vázquez, Saulo A. 2012. "Intermolecular potentials for simulations of collisions of SiNCS+ and (CH3)2SiNCS+ ions with fluorinated self-assembled monolayers", Chemical Physics 399, .: 193 - 204.
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5. |
Abreu, P. E; Marques, J. M. C; Pereira, F. B. 2011. "Electronic structure calculations on the Ar-C6H12 interaction: Application to the microsolvation of the chair conformer", Computational and Theoretical Chemistry 975, 1-3: 83 - 91.
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6. |
Llanio-Trujillo, J. L; Marques, J. M. C; Pereira, F. B. 2011. "An Evolutionary Algorithm for the Global Optimization of Molecular Clusters: Application to Water, Benzene, and Benzene Cation", Journal of Physical Chemistry A 115, 11: 2130 - 2138.
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7. |
Almeida, Marcos M; Prudente, Frederico V; Fellows, Carlos E; Marques, Jorge M. C; Pereira, Francisco B. 2011. "Direct fit of spectroscopic data of diatomic molecules by using genetic algorithms: II. The ground state of RbCs", Journal of Physics B: Atomic, Molecular and Optical Physics 44, 22: 225102 - 225102.
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8. |
Marques, J. M. C; Llanio-Trujillo, J. L; Abreu, P. E; Pereira, F. B. 2010. "How Different Are Two Chemical Structures?", Journal of Chemical Information and Modeling 50, 12: 2129 - 2140.
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9. |
Marques, J. M. C; Pais, A. A. C. C; Abreu, P. E. 2010. "Generation and Characterization of Low-Energy Structures in Atomic Clusters", Journal of Computational Chemistry 31, 7: 1495 - 1503.
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10. |
Marques, J. M. C; Pereira, F. B. 2010. "An evolutionary algorithm for global minimum search of binary atomic clusters", Chemical Physics Letters 485, 1-3: 211 - 216.
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11. |
Valente, Artur J. M; Ribeiro, Ana. C. F; Marques, Jorge M. C; Abreu, Paulo E; Lobo, Victor M. M; Kataky, Ritu. 2010. " Transport Properties of Aqueous Solutions of (1 R ,2 S )-(-)-
and (1 S ,2 R )-(+)-Ephedrine Hydrochloride at Different Temperatures
", Journal of Chemical & Engineering Data 55, 3: 1145 - 1152.
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12. |
Prudente, Frederico V; Marques, Jorge M. C; Maniero, Angelo M. 2009. "Time-dependent wave packet calculation of the LiH plus H reactive scattering on a new potential energy surface", Chemical Physics Letters 474, 1-3: 18 - 22.
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13. |
Pereira, Francisco B; Marques, Jorge M. C. 2009. "A study on diversity for cluster geometry optimization", Evolutionary Intelligence 2, 3: 121 - 140.
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14. |
Marques, J. M. C; Pereira, F. B; Leitao, T.. 2008. "On the use of different potential energy functions in rare-gas cluster optimization by genetic algorithms: Application to
argon clusters", Journal of Physical Chemistry A 112, 27: 6079 - 6089.
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15. |
Poiares, Joao P. M; Rodrigues, Sergio P. J; Marques, Jorge M. C. 2008. "A quantum mechanics toolkit", Journal of Chemical Education 85, 4: 591 - 591. |
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16. |
Marques, J M. C; Prudente, F V; Pereira, F B; Almeida, M M; Maniero, A M; Fellows, C E. 2008. " A new genetic algorithm to be used in the direct fit of potential energy curves to ab initio
and spectroscopic data ", Journal of Physics B: Atomic, Molecular and Optical Physics 41, 8: 085103 - 085103.
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17. |
Fernandez-Ramos, Antonio; Ellingson, Benjamin A; Meana-Paneda, Ruben; Marques, Jorge M. C; Truhlar, Donald G. 2007. "Symmetry numbers and chemical reaction rates", Theoretical Chemistry Accounts 118, 4: 813 - 826.
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18. |
Teixeira, O. B. M; Marques, J. M. C; Varandas, A. J. C. 2007. "Kinetics and dynamics of O + OC1O reaction in a modified many-body expansion potential energy surface for ClO3", International Journal of Chemical Kinetics 39, 7: 422 - 430.
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19. |
Marques, J. M. C; Martinez-Nunez, E.; Vazquez, S. A. 2006. "Trajectory dynamics study of collision-induced dissociation of the Ar+CH(4) reaction at hyperthermal conditions: Vibrational
excitation and isotope substitution", Journal of Physical Chemistry A 110, 22: 7113 - 7121.
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20. |
Pereira, Francisco B; Marques, Jorge M. C; Leitão, Tiago; Tavares, Jorge. 2006. " Analysis of locality in hybrid evolutionary cluster optimization ", 2006 IEEE CONGRESS ON EVOLUTIONARY COMPUTATION (Vol. 1-6), .: 2270 - 2277. |
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21. |
Marques, J. M. C; Martinez-Nunez, E.; Fernadez-Ramos, A.; Vazquez, S. A. 2005. "Trajectory dynamics study of the Ar+CH4 dissociation reaction at high temperatures: the importance of zero-point-energy effects", Journal of Physical Chemistry A 109, 24: 5415 - 5423.
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22. |
Martinez-Nun~ez, Emilio; Fernandez-Ramos, Antonio; Vazquez, Saulo A; Marques, Jorge M. C; Xue, Mingying; Hase, William L. 2005. "Quasiclassical dynamics simulation of the collision-induced dissociation of Cr(CO)[sub 6][sup +] with Xe", The Journal of Chemical Physics 123, 15: 154311 - 154311.
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23. |
Martinez-Nunez, E.; Vazquez, S. A; Marques, J. M. C. 2004. "Quasiclassical trajectory study of the collision-induced dissociation of CH3SH++Ar", Journal of Chemical Physics 121, 6: 2571 - 2577.
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24. |
Teixeira, O. B. M; Marques, J. M. C; Varandas, A. J. C. 2004. "Dynamics study of CIO+O-2 collisions and their role in the chemistry of stratospheric ozone", Physical Chemistry Chemical Physics 6, 9: 2179 - 2184.
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25. |
Fernandez-Ramos, A.; Martinez-Nunez, E.; Marques, J. M. C; Vazquez, S. A. 2003. "Dynamics calculations for the Cl+C2H6 abstraction reaction: Thermal rate constants and kinetic isotope effects", Journal of Chemical Physics 118, 14: 6280 - 6288.
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26. |
Marques, J. M. C; Riganelli, A.; Varandas, A. J. C. 2003. "Classical trajectory method: A+BC coplanar collisions", Quimica Nova 26, 5: 769 - 778. |
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27. |
Prudente, F. V; Riganelli, A.; Marques, J. M. C. 2003. "Time dependent wave packet study of the electronically non-adiabatic Cl+H-2 reaction using a one-dimensional model", Physical Chemistry Chemical Physics 5, 11: 2354 - 2359.
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28. |
Marques, J. M. C; Voronin, A. I; Varandas, A. J. C. 2002. "Li+Li-2 dissociation reaction using the self-consistent potential and trajectory surface hopping methods", Journal of Physical Chemistry A 106, 15: 3673 - 3680.
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29. |
Marques, J. M. C; Varandas, A. J. C. 2001. "Reply to the 'Comment on "On the high pressure rate constants for the H/Mu+O-2 addition reactions''' by L. B. Harding, J.
Troe and V. G. Ushakov, Phys. Chem. Chem. Phys., 2001, 3, 2630", Physical Chemistry Chemical Physics 3, 13: 2632 - 2633.
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30. |
Marques, J. M. C; Varandas, A. J. C. 2001. "On the high pressure rate constants for the H/Mu+O-2 addition reactions", Physical Chemistry Chemical Physics 3, 4: 505 - 507.
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31. |
Martinez-Nunez, E.; Marques, J. M. C; Vazquez, S. A. 2001. "A direct dynamics study of the H-2 elimination from 2,5-dihydrofuran", Journal of Chemical Physics 115, 17: 7872 - 7880. |
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32. |
Marques, J. M. C; Llanio-Trujillo, J. L; Varandas, A. J. C. 2000. "Isotope effect on unimolecular dissociation of MuO(2): a classical trajectory study", Physical Chemistry Chemical Physics 2, 16: 3583 - 3589.
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33. |
Llanio-Trujillo, J. L; Marques, J. M. C; Varandas, A. J. C. 1999. "Mode specificity study in unimolecular dissociation of nonrotating H2O, DHO, and MuHO molecules", Journal of Physical Chemistry A 103, 50: 10907 - 10914.
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34. |
Marques, J. M. C; Voronin, A. I; Varandas, A. J. C. 1999. "Comparative trajectory surface hopping study for the Li+Li-2(X (1)Sigma(g) (+)), Na+Li-2(X (1)Sigma(g) (+)) and Li+Na-2(X
(1)Sigma(g) (+)) dissociation reactions", Physical Chemistry Chemical Physics 1, 11: 2657 - 2665.
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35. |
Voronin, A. I; Marques, J. M. C; Varandas, A. J. C. 1998. "Trajectory surface hopping study of the Li+Li-2(X-1 Sigma(+)(g)) dissociation reaction", Journal of Physical Chemistry A 102, 30: 6057 - 6062.
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36. |
Marques, J. M. C; Varandas, A. J. C. 1997. "Classical trajectory study of mode specificity and rotational effects in unimolecular dissociation of HO2", Journal of Physical Chemistry A 101, 28: 5168 - 5173.
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37. |
Marques, J. M. C; Wang, W.; Pais, Aacc; Varandas, A. J. C. 1996. "Dynamics study of the H+ArO2 multichannel reaction", Journal of Physical Chemistry 100, 44: 17513 - 17522.
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38. |
Varandas, A. J. C; Pais, Aacc; Marques, J. M. C; Wang, W.. 1996. "On the chaperon mechanism for association rate constants: The formation of HO2 and O-3", Chemical Physics Letters 249, 3-4: 264 - 271.
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39. |
Marques, J. M. C; Wang, W. L; Varandas, A. J. C. 1994. "DYNAMICS CALCULATIONS AND ISOTOPIC EFFECT IN O+OH(D)- O-2+H(D) AT LOW ENERGIES", Journal of the Chemical Society-Faraday Transactions 90, 15: 2189 - 2200.
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40. |
Varandas, A. J. C; Marques, J. M. C. 1994. "METHOD FOR QUASI-CLASSICAL TRAJECTORY CALCULATIONS ON POTENTIAL-ENERGY SURFACES DEFINED FROM GRADIENTS AND HESSIANS, AND MODEL
TO CONSTRAIN THE ENERGY IN VIBRATIONAL-MODES", Journal of Chemical Physics 100, 3: 1908 - 1920.
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41. |
Marques, J. M. C; Varandas, A. J. C. 1994. "QCT-IEQMT calculations of thr O(3P)+OD(2II) reaction at low energies.", Anales de Física. Universidad del País Vasco. 90, 3: 284 - 292. |
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42. |
Varandas, A. J. C; Pais, A. A. C. C; Marques, J. M. C. 1994. "Estudos teóricos de reacções químicas elementares: da energética à dinâmica.", Memórias da Academia das Ciências de Lisboa, Academia das Ciências de Lisboa: Lisboa, .: 197 - 234. |
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43. |
Varandas, A. J. C; Marques, J. M. C. 1992. "A DETAILED STATE-TO-STATE LOW-ENERGY DYNAMICS STUDY OF THE REACTION O(P-3) + OH(2-PI)- O2((X)OVER-TILDE3-SIGMA-G-)+H(S-2)
USING A QUASI-CLASSICAL TRAJECTORY-INTERNAL-ENERGY QUANTUM-MECHANICAL-THRESHOLD METHOD", Journal of Chemical Physics 97, 6: 4050 - 4065.
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Trabalhos completos/resumidos em eventos com arbitragem científica Papers in conference proceedings with scientific refereeing |
1. |
Pereira, Francisco B; Marques, Jorge M. C. 2010. "Towards an effective evolutionary approach for binary Lennard-Jones clusters", Trabalho apresentado em 2010 IEEE Congress on Evolutionary Computation (CEC), In IEEE Congress on Evolutionary Computation, Barcelona, Spain.
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2. |
Pereira, Francisco B; Marques, Jorge M. 2008. "A Hybrid Evolutionary Algorithm for Cluster Geometry Optimization: The Importance of Structural Elitism", Trabalho apresentado em 2008 8th International Conference on Hybrid Intelligent Systems (HIS), In 2008 Eighth International Conference on Hybrid Intelligent Systems, Barcelona, Spain.
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3. |
Pereira, Francisco B; Marques, Jorge M. 2008. "A Self-Adaptive Evolutionary Algorithm for Cluster Geometry Optimization", Trabalho apresentado em 2008 8th International Conference on Hybrid Intelligent Systems (HIS), In 2008 Eighth International Conference on Hybrid Intelligent Systems, Barcelona, Spain.
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Indicadores de produção
(Production indicators)
Produção científica
Scientific production |
Produção científica Scientific production |
47 |
Livros e capítulos Books and book chapters |
1 |
Capítulos de livros publicados Published book chapters |
1 |
Artigos científicos em revistas Papers in periodics |
43 |
Com arbitragem científica With scientific refereeing |
43 |
Trabalhos em eventos Papers in conference proceedings |
3 |
Com arbitragem científica With scientific refereeing |
3 |
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