Noelia Faginas Lago

According to our database1, Noelia Faginas Lago authored at least 29 papers between 2003 and 2018.

Collaborative distances:
  • Dijkstra number2 of five.
  • Erdős number3 of five.

Timeline

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PhD thesis 
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Bibliography

2018
Nitrogen Gas on Graphene: Pairwise Interaction Potentials.
Proceedings of the Computational Science and Its Applications - ICCSA 2018, 2018

A Theoretical Investigation of the Reaction H+SiS2 and Implications for the Chemistry of Silicon in the Interstellar Medium.
Proceedings of the Computational Science and Its Applications - ICCSA 2018, 2018

Confinement of the Pentanitrogen Cation Inside Carbon Nanotubes.
Proceedings of the Computational Science and Its Applications - ICCSA 2018, 2018

Potential Energy Surface for the Interaction of Helium with the Chiral Molecule Propylene Oxide.
Proceedings of the Computational Science and Its Applications - ICCSA 2018, 2018

2017
Acetone-Water Mixtures: Molecular Dynamics Using a Semiempirical Intermolecular Potential.
Proceedings of the Computational Science and Its Applications - ICCSA 2017, 2017

2016
A Theoretical Study on the Relevance of Protonated and Ionized Species of Methanimine and Methanol in Astrochemistry.
Proceedings of the Computational Science and Its Applications - ICCSA 2016, 2016

Modeling Combustions: The ab initio Treatment of the O( ^3 P) + CH _3 OH Reaction.
Proceedings of the Computational Science and Its Applications - ICCSA 2016, 2016

Collisional Energy Exchange in CO _2 -N _2 Gaseous Mixtures.
Proceedings of the Computational Science and Its Applications - ICCSA 2016, 2016

Acetone Clusters Molecular Dynamics Using a Semiempirical Intermolecular Potential.
Proceedings of the Computational Science and Its Applications - ICCSA 2016, 2016

A Theoretical and Computational Approach to a Semi-classical Model for Electron Spectroscopy Calculations in Collisional Autoionization Processes.
Proceedings of the Computational Science and Its Applications - ICCSA 2016, 2016

2015
A Theoretical Investigation of 1-Butanol Unimolecular Decomposition.
Proceedings of the Computational Science and Its Applications - ICCSA 2015, 2015

Ion-Water Cluster Molecular Dynamics Using a Semiempirical Intermolecular Potential.
Proceedings of the Computational Science and Its Applications - ICCSA 2015, 2015

2014
Grid Calculation Tools for Massive Applications of Collision Dynamics Simulations: Carbon Dioxide Energy Transfer.
Proceedings of the Computational Science and Its Applications - ICCSA 2014 - 14th International Conference, Guimarães, Portugal, June 30, 2014

The Molecular Stirrer Catalytic Effect in Methane Ice Formation.
Proceedings of the Computational Science and Its Applications - ICCSA 2014 - 14th International Conference, Guimarães, Portugal, June 30, 2014

2013
A high-level ab initio study of the N2 + N2 reaction channel.
Journal of Computational Chemistry, 2013

Carbon Oxides in Gas Flows and Earth and Planetary Atmospheres: State-to-State Simulations of Energy Transfer and Dissociation Reactions.
Proceedings of the Computational Science and Its Applications - ICCSA 2013, 2013

Water (H2O) m or Benzene (C6H6) n Aggregates to Solvate the K + ?
Proceedings of the Computational Science and Its Applications - ICCSA 2013, 2013

Modeling the Intermolecular Interactions and Characterization of the Dynamics of Collisional Autoionization Processes.
Proceedings of the Computational Science and Its Applications - ICCSA 2013, 2013

2012
An extension of the grid empowered molecular simulator to quantum reactive scattering.
Journal of Computational Chemistry, 2012

A Bond-Bond Portable Approach to Intermolecular Interactions: Simulations for N-methylacetamide and Carbon Dioxide Dimers.
Proceedings of the Computational Science and Its Applications - ICCSA 2012, 2012

2010
COMPCHEM: Progress Towards GEMS a Grid Empowered Molecular Simulator and Beyond.
J. Grid Comput., 2010

Distributed and Collaborative Learning Objects Repositories on Grid Networks.
Proceedings of the Computational Science and Its Applications, 2010

2009
A Grid Implementation of Direct Quantum Calculations of Rate Coefficients.
Proceedings of the Computational Science and Its Applications, 2009

A Grid Implementation of Direct Semiclassical Calculations of Rate Coefficients.
Proceedings of the Computational Science and Its Applications, 2009

2007
Quantum vs Semiclassical Dynamics Approaches from highly symmetric to asymmetric reactions.
Proceedings of the Selected Papers of the Fifth International Conference on, 2007

2006
A Simplified Myoglobin Model for Molecular Dynamics Calculations.
Proceedings of the Computational Science and Its Applications, 2006

2005
Thermal Rate Coefficients for the N+N2 Reaction: Quasiclassical, Semiclassical and Quantum Calculations.
Proceedings of the Computational Science and Its Applications, 2005

2004
Foreword.
Future Generation Comp. Syst., 2004

2003
Initial Value Semiclassical Approaches to Reactive and Non Reactive Transition Probabilities.
Proceedings of the Computational Science - ICCS 2003, 2003


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