Universidad Politécnica de Madrid - Magerit Node

From AnnualReport

Jump to: navigation, search

Overview

Magerit Supercomputer

CeSViMa (Supercomputing and Visualization Centre of Madrid, in Spanish "Centro de Supercomputación y Visualización de Madrid") is located in the Excellent IT and Technology Transfer Montegancedo Campus, one of the sites of the Technical University of Madrid Science & Technology Park. CeSViMa, which is a member of the Spanish Supercomputing Network (RES), Spanish e-Science Network and Madrid Laboratories and Infrastructures Network, focuses on three main objectives:

  • High Performance Computing
  • Advanced Interactive Visualisation
  • Massive Storage

CeSViMa's supercomputer is called Magerit (the ancient recorded name of Madrid). The second version of this supercomputer is a cluster of 245 nodes PS702, that provides almost 4000 CPUs and 200 TB of storage inter-connected by a very high bandwidth switch. The nodes are interconnected with a high bandwidth and low latency infiniband network.



Organisational Structure

CeSViMa Team as of January 2014




Technical and Scientific Highlights 2014

Key Publications 2014

Articles

  • Analysis of SnS2 hyperdoped with V proposed as efficient absorber material, Yohanna Seminovski, Pablo Palacios y Perla Wahnón.
  • Ab initio molecular dynamics: Relationship between structural phases and the sound velocity in dense hydrogen, Carlo L. Guerrero, Santiago Cuesta-Lopez y José M. Perlado.
  • Distributed Estimation of Distribution Algorithms for continuous optimization: How does the exchanged information influence their behavior?, S. Muelas, A. Mendiburu, A. LaTorre y J. Peña.
  • Effect of the computational domain on direct simulations of turbulent channels up to Re?=4200, Adrián Lozano-Durán y Javier Jiménez.
  • Fast ignition driven by quasi-monoenergetic ions: Optimal ion type and reduction of the ignition energies with an ion beam array, J.J. Honrubia, J.C. Fernandez, B.M. Hegelich, M. Murakami y C.D. Enriquez.
  • Hybrid Quantum Magnetism in Circuit QED: From Spin-Photon Waves to Many-Body Spectroscopy, Andreas Kurcz, Alejandro Bermudez y Juan José García-Ripoll.
  • Maturation of Rhizobium leguminosarum Hydrogenase in the Presence of Oxygen Requires the Interaction of the Chaperone HypC and the Scaffolding Protein HupK, Marta Albareda, Luis F. Pacios, Hamid Manyani, Luis Rey, Belén Brito, Juan Imperial, Tomás Ruiz-Argüeso y José M. Palacios.
  • Molecular Dynamics of Major Allergens from Alternaria, Birch Pollen and Peach, María Garrido-Arandia, Cristina Gómez-Casado, Araceli Díaz-Perales y Luis F. Pacios.
  • Quantum metropolitan optical network based on wavelength division multiplexing, A. Ciurana, J. Martínez-Mateo, M. Peev, A. Poppe, N. Walenta, H. Zbinden y V. Martín.
  • Self-consistent relativistic band structure of the CH3NH3PbI3 perovskite, E. Menéndez-Proupin, P. Palacios, P. Wahnón y J.C. Conesa.
  • Time-resolved evolution of coherent structures in turbulent channels: characterization of eddies and cascades, Adrián Lozano-Durán y Javier Jiménez.
  • Twinning of Polymer Crystals Suppressed by Entropy, N. C. Karayiannis, K. Foteinopoulou y M. Laso.
  • V-substituted In2S3: an intermediate band material with photocalalytic in the whole visible light range, R. Lucena, J.C. Conesa, I. Aguilera, P. Palacios y P. Wahnón.

Phd Thesis

  • Theoretical Study of Thermodynamic and Optoelectronic Properties of New Intermediate Band Photovoltaic Materials, Yohanna Seminovski Pérez.

Proceedings

  • New Generation of Materials for More Efficient Solar Energy Use: Quantum Modelling and Experimental Realizations, P. Wahnón, P. Palacios, I. Aguilera, Y. Seminovski, R. Lucena y J.C. Conesa.

Conference

  • Designer-driven 3D Buildings Generated Using Variable Neighbourhood Search, J.M. Peña, J. Viedma, S. Muelas, A. LaTorre y L. Peña..
  • Packing of athermal polymers in the bulk and under confinement, P. Ramos, K. Foteinopoulou, N. C. Karayiannis y M. Laso.

Technical Report

  • Hydrodynamic and acoustic results of the AQUO propeller., Leo M. González.

Misc

  • Monte Carlo simulations of athermal polymers under confinement, P. Ramos.


Key Projects 2014

  • Implementation of new exchange correlation functionals and molecular dynamics calculations in Octopus, Joseba Alberdi.
  • Sulfur Dioxide Capture by Ionic Liquids from a molecular point of view: A Density Functional Theory Study, Santiago Aparicio.
  • Study of bulk and nanoconfined liquid water from ab initio simulations, Emilio Artacho.
  • Evaluación de métricas de similaridad aplicadas a sistemas de recomendación, Jesús Bobadilla Sancho.
  • Ketonic decarboxylation over metal oxides: MgO and ZrO2, Mercedes Boronat.
  • Understanding the dynamics of water-silicate interactions at the nanoscale, Stefan Bromley.
  • Investigating the protomeric space of Hairpin DNA by CPMD simulations, Paolo Carloni.
  • Simulación de agua subenfriada, Jose Antonio Cobos Marquez.
  • Parameter Control of Genetic Algorithms, Juan Antonio Fernández del Pozo de Salamanca.
  • Catalysis modelling: gold nanoparticles supported on yttrium modified anatase as efficient WGS and CO oxidation catalysts, Javier Fernández Sanz.
  • Complex flow calculations oriented to Biofluid and Liquid Crystalline Flows, Katerina Foteinopoulou.
  • QUITEMAD: QUINFOG, Juan José García Ripoll.
  • Cálculo de inestabilidades de flujos aerodinámicos, Leo González.
  • Mining Software Repositories, Israel Herraiz Tabernero.
  • Ignición rápida de blancos fusion inercial: desde la aceleración de electrones hasta la ignición del combustible, José Javier Honrubia Checa.
  • Electronic structure of semiconductors by means of quasiparticle calculations: relevance to photocatalysis, Francesc Illas.
  • Simulacion del comportamiento en solucion de proteinas implicadas en el ensamblaje de la hidrogenasa, Juan Imperial Ródenas.
  • Aplicación de supercomputación distribuida al análisis de secuencias genómicas y a la modelización enzimática, Juan Imperial Ródenas.
  • Caracterización del microbioma de la caña de azúcar, Juan Imperial Ródenas.
  • Aplicación de la física estadística a la mecánica de medios granulares, Rafael Jimenez.
  • Modelling of Synthetic and Biological Micromolecules Through a Hierarchical Multiscale Approach, Nikos Karayiannis.
  • Determination of the Stress-optical coefficient and plateau modulus from atomistic simulations of polyethylene melts, Vicente Lorenzo.
  • Multiscale dynamics of turbulent flows, Adrián Lozano Durán.
  • QUITEMAD: Cryptography, Computation and Simulation, Miguel Ángel Martín-Delgado Alcántara.
  • Constraints on inflationary models of the universe based on CMB data, Enrique Martinez Gonzalez.
  • Formation energies of point defects in cadmium telluride, Eduardo Menéndez.
  • Effect of defects on the two-photon photoemission (2PP) resonance for methanol and water on TiO2(110), Annapaola Migani.
  • Heart visualization and supervised classification, Maria Montoya.
  • Advanced high-performance vehicle routing & scheduling through emerging parallel architectures ADITI, Santiago Muelas Pascual.
  • Theoretical Characterization of the optimized geometry and energy levels in an hybrid nanostructure, Pablo Palacios Clemente.
  • Blue Brain Project, José María Peña Sánchez.
  • Optimization Algorithms, José María Peña Sánchez.
  • Simulación de estructuras con dinámica molecular cuántica, José Manuel Perlado Martín.
  • PNOF5-PT2: A new benchmark tool in computational chemistry, Mario Piris.
  • Binding of glycosylated surfactants to concanavalin A, Antoni Planas.
  • Evidence of Conformational Selection in a Glycosyltransferase Structure, Antoni Planas.
  • Metodo Montecarlo en resolucion de problemas competitivos, Alfonso Rodriguez-Paton.
  • Octopus GS and TD scaling testing in new architectures, Angel Rubio.
  • Sistema de predicción de la calidad del aire de tercera generación, Roberto San José García.
  • Development of a numerical multiphase flow tool for applications to petroleum Industry, Eusebio Valero Sánchez.
  • Validación de herramientas Xflow en configuraciones de High-Lift, Eusebio Valero Sánchez.
  • Diseño, Síntesis y Caracterización de Materiales Fotovoltaicos Avanzados de Alta Eficiencia, Perla Wahnón Benarroch.
  • Design and Characterization of Advanced Photovoltaic Materials with High Efficiency, Perla Wahnón Benarroch.
  • Electronic and optical properties of two-dimensional materials. Graphene and transition metal dichalcogenides, Ludger Wirtz.


Personal tools
Home