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	1.	An automated transition state search using classical trajectories initialized at multiple minima. [electronic resource] by Martínez-Núñez, Emilio Producer: 20150728 In: Physical chemistry chemical physics : PCCP vol. 17 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	2.	An automated method to find transition states using chemical dynamics simulations. [electronic resource] by Martínez-Núñez, Emilio Producer: 20150731 In: Journal of computational chemistry vol. 36 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	3.	Quasiclassical trajectory calculations on the photodissociation of CF2CHCl at 193 nm: product energy distributions for the HF and HCl eliminations. [electronic resource] by Martínez-Núñez, Emilio Vázquez, Saulo Producer: 20060427 In: The Journal of chemical physics vol. 122 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	4.	Rovibrational distributions of HF in the photodissociation of vinyl fluoride at 193 nm: a direct MP2 quasiclassical trajectory study. [electronic resource] by Martínez-Núñez, Emilio Vázquez, Saulo Producer: 20061207 In: The Journal of chemical physics vol. 121 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	5.	Acceleration of Classical Mechanics by Phase Space Constraints. [electronic resource] by Martínez-Núñez, Emilio Shalashilin, Dmitrii V Producer: 20151205 In: Journal of chemical theory and computation vol. 2 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	6.	HCN elimination from vinyl cyanide: product energy partitioning, the role of hydrogen-deuterium exchange reactions and a new pathway. [electronic resource] by Vázquez, Saulo A Martínez-Núñez, Emilio Producer: 20150521 In: Physical chemistry chemical physics : PCCP vol. 17 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	7.	Representing and selecting vibrational angular momentum states for quasiclassical trajectory chemical dynamics simulations. [electronic resource] by Lourderaj, Upakarasamy Martínez-Núñez, Emilio Hase, William L Producer: 20071120 In: The journal of physical chemistry. A vol. 111 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	8.	Quasi-Classical Trajectory Dynamics Study of the Cl( [electronic resource] by Espinosa-Garcia, Joaquin Martinez-Nuñez, Emilio Rangel, Cipriano Producer: 20180321 In: The journal of physical chemistry. A vol. 122 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	9.	Collision-induced dissociation mechanisms of [Li(uracil)]+. [electronic resource] by Rodríguez-Fernández, Roberto Vázquez, Saulo A Martínez-Núñez, Emilio Producer: 20131126 In: Physical chemistry chemical physics : PCCP vol. 15 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	10.	Photodissociation of acryloyl chloride at 193 nm: interpretation of the product energy distributions, and new elimination pathways. [electronic resource] by Pérez-Soto, Raúl Vázquez, Saulo A Martínez-Núñez, Emilio Producer: 20160719 In: Physical chemistry chemical physics : PCCP vol. 18 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	11.	Specific Reaction Parameter Multigrid POTFIT (SRP-MGPF): Automatic Generation of Sum-of-Products Form Potential Energy Surfaces for Quantum Dynamical Calculations. [electronic resource] by Panadés-Barrueta, Ramón L Martínez-Núñez, Emilio Peláez, Daniel Publication details: Frontiers in chemistry 2019 In: Frontiers in chemistry vol. 7 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	12.	A Trajectory-Based Method to Explore Reaction Mechanisms. [electronic resource] by Vázquez, Saulo A Otero, Xose L Martinez-Nunez, Emilio Producer: 20190305 In: Molecules (Basel, Switzerland) vol. 23 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	13.	Quasiclassical trajectory study of the collision-induced dissociation of CH3SH+ + Ar. [electronic resource] by Martínez-Núñez, Emilio Vázquez, Saulo A Marques, Jorge M C Producer: 20061005 In: The Journal of chemical physics vol. 121 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	14.	Editorial: Application of Optimization Algorithms in Chemistry. [electronic resource] by Marques, Jorge M C Martínez-Núñez, Emilio Hase, William L Publication details: Frontiers in chemistry 2020 In: Frontiers in chemistry vol. 8 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	15.	Methanol dimer formation drastically enhances hydrogen abstraction from methanol by OH at low temperature. [electronic resource] by Siebrand, Willem Smedarchina, Zorka Martínez-Núñez, Emilio Fernández-Ramos, Antonio Producer: 20180129 In: Physical chemistry chemical physics : PCCP vol. 18 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	16.	Theoretical and computational studies of non-equilibrium and non-statistical dynamics in the gas phase, in the condensed phase and at interfaces. [electronic resource] by Spezia, Riccardo Martínez-Nuñez, Emilio Vazquez, Saulo Hase, William L Publication details: Philosophical transactions. Series A, Mathematical, physical, and engineering sciences Apr 2017 In: Philosophical transactions. Series A, Mathematical, physical, and engineering sciences vol. 375 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	17.	On the gas phase fragmentation of protonated uracil: a statistical perspective. [electronic resource] by Rossich Molina, Estefanía Salpin, Jean-Yves Spezia, Riccardo Martínez-Núñez, Emilio Producer: 20171228 In: Physical chemistry chemical physics : PCCP vol. 18 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	18.	Ab initio and RRKM study of the HCN/HNC elimination channels from vinyl cyanide. [electronic resource] by Homayoon, Zahra Vázquez, Saulo A Rodríguez-Fernández, Roberto Martínez-Núñez, Emilio Producer: 20110523 In: The journal of physical chemistry. A vol. 115 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	19.	Dynamics of Mg+ + H2O + He: capture, collisional stabilization and collision-induced dissociation. [electronic resource] by Martínez-Núñez, Emilio Whalley, Charlotte L Shalashilin, Dmitry Plane, John M C Producer: 20100916 In: The journal of physical chemistry. A vol. 114 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	20.	The role of aromaticity in the planarity of lumiflavin. [electronic resource] by Rodríguez-Otero, Jesús Martínez-Núñez, Emilio Peña-Gallego, Angeles Vázquez, Saulo A Producer: 20030404 In: The Journal of organic chemistry vol. 67 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)

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Your search returned 35 results.