Folgen
Jorge M. C. Marques
Jorge M. C. Marques
Bestätigte E-Mail-Adresse bei ci.uc.pt - Startseite
Titel
Zitiert von
Zitiert von
Jahr
Symmetry numbers and chemical reaction rates
A Fernández-Ramos, BA Ellingson, R Meana-Pañeda, JMC Marques, ...
Theoretical Chemistry Accounts 118, 813-826, 2007
4102007
An evolutionary algorithm for the global optimization of molecular clusters: application to water, benzene, and benzene cation
JL Llanio-Trujillo, JMC Marques, FB Pereira
The Journal of Physical Chemistry A 115 (11), 2130-2138, 2011
802011
An evolutionary algorithm for global minimum search of binary atomic clusters
JMC Marques, FB Pereira
Chemical Physics Letters 485 (1-3), 211-216, 2010
802010
Method for quasiclassical trajectory calculations on potential energy surfaces defined from gradients and Hessians, and model to constrain the energy in vibrational modes
AJC Varandas, JMC Marques
The Journal of chemical physics 100 (3), 1908-1920, 1994
761994
On the chaperon mechanism for association rate constants: the formation of HO2 and O3
AJC Varandas, A Pais, JMC Marques, W Wang
Chemical physics letters 249 (3-4), 264-271, 1996
591996
A detailed state‐to‐state low‐energy dynamics study of the reaction O(3P)+OH(2Π)→O2(X̃ 3Σg)+H(2S) using a quasiclassical trajectory–internal …
AJC Varandas, JMC Marques
The Journal of chemical physics 97 (6), 4050-4065, 1992
591992
Quasiclassical dynamics simulation of the collision-induced dissociation of Cr (CO) 6+ with Xe
E Martínez-Núñez, A Fernández-Ramos, SA Vázquez, J Marques, M Xue, ...
The Journal of chemical physics 123 (15), 2005
552005
A study on diversity for cluster geometry optimization
FB Pereira, JMC Marques
Evolutionary Intelligence 2, 121-140, 2009
512009
A new genetic algorithm to be used in the direct fit of potential energy curves to ab initio and spectroscopic data
JMC Marques, FV Prudente, FB Pereira, MM Almeida, AM Maniero, ...
Journal of Physics B: Atomic, Molecular and Optical Physics 41 (8), 085103, 2008
502008
Trajectory Dynamics Study of the Ar + CH4 Dissociation Reaction at High Temperatures:  the Importance of Zero-Point-Energy Effects
JMC Marques, E Martinez-Nuñez, A Fernandez-Ramos, SA Vázquez
The Journal of Physical Chemistry A 109 (24), 5415-5423, 2005
482005
Time-dependent wave packet calculation of the LiH+ H reactive scattering on a new potential energy surface
FV Prudente, JMC Marques, AM Maniero
Chemical Physics Letters 474 (1-3), 18-22, 2009
472009
How different are two chemical structures?
JMC Marques, JL Llanio-Trujillo, PE Abreu, FB Pereira
Journal of Chemical information and Modeling 50 (12), 2129-2140, 2010
422010
Modeling coronene nanostructures: analytical potential, stable configurations and ab initio energies
M Bartolomei, F Pirani, JMC Marques
The Journal of Physical Chemistry C 121 (26), 14330-14338, 2017
332017
Trajectory Surface Hopping Study of the Li + Li2(XΣg+) Dissociation Reaction
AI Voronin, JMC Marques, AJC Varandas
The Journal of Physical Chemistry A 102 (30), 6057-6062, 1998
331998
On the high pressure rate constants for the H/Mu+ O 2 addition reactions
JMC Marques, AJC Varandas
Physical Chemistry Chemical Physics 3 (4), 505-507, 2001
322001
A global optimization perspective on molecular clusters
JMC Marques, FB Pereira, JL Llanio-Trujillo, PE Abreu, M Albertí, ...
Philosophical Transactions of the Royal Society A: Mathematical, Physical …, 2017
312017
Analysis of locality in hybrid evolutionary cluster optimization
FB Pereira, JMC Marques, T Leitão, J Tavares
2006 IEEE International Conference on Evolutionary Computation, 2285-2292, 2006
312006
Quasiclassical trajectory study of the collision-induced dissociation of
E Martınez-Núnez, SA Vázquez, JMC Marques
The Journal of chemical physics 121 (6), 2571-2577, 2004
312004
Low‐energy structures of benzene clusters with a novel accurate potential surface
M Bartolomei, F Pirani, JMC Marques
Journal of Computational Chemistry 36 (31), 2291-2301, 2015
302015
Designing efficient evolutionary algorithms for cluster optimization: A study on locality
FB Pereira, JMC Marques, T Leitão, J Tavares
Advances in metaheuristics for hard optimization, 223-250, 2008
302008
Das System kann den Vorgang jetzt nicht ausführen. Versuchen Sie es später erneut.
Artikel 1–20