8th Congress on Electronic Structure: Principles and Applications (ESPA 2012)

A Conference Selection from Theoretical Chemistry Accounts

  • Juan J. Novoa
  • Manuel F. Ruiz López

Part of the Highlights in Theoretical Chemistry book series (HITC, volume 5)

Table of contents

  1. Front Matter
    Pages i-vi
  2. Juan J. Novoa, Manuel F. Ruiz-López
    Pages 1-4
  3. Mario Piris, Jon M. Matxain, Xabier Lopez, Jesus M. Ugalde
    Pages 5-15
  4. R. Verzeni, O. Mó, A. Cimas, I. Corral, M. Yáñez
    Pages 17-26
  5. Josep M. Oliva, Diego R. Alcoba, Luis Lain, Alicia Torre
    Pages 27-32
  6. Luis Miguel Azofra, Muhannad Altarsha, Manuel F. Ruiz-López, Francesca Ingrosso
    Pages 33-41
  7. J. J. Santoyo-Flores, A. Cedillo, M. I. Bernal-Uruchurtu
    Pages 43-49
  8. Sebastián Sastre, Rodrigo Casasnovas, Francisco Muñoz, Juan Frau
    Pages 51-58
  9. Sławomir J. Grabowski
    Pages 59-68
  10. Manuel Monge-Palacios, Cipriano Rangel, Joaquin Espinosa-García, Hong Fu, Minghui Yang
    Pages 69-78
  11. Patricia Vindel-Zandbergen, Mirjam Falge, Bo Y. Chang, Volker Engel, Ignacio R. Sola
    Pages 79-88
  12. Maitreyi Robledo, Fernando Martín, Manuel Alcamí, Sergio Díaz-Tendero
    Pages 89-96
  13. Nina Emel’yanova, Nataliya Sanina, Alexander Krivenko, Roman Manzhos, Konstantin Bozhenko, Sergey Aldoshin
    Pages 97-104
  14. M. Merced Montero-Campillo, Al Mokhtar Lamsabhi, Otilia Mó, Manuel Yáñez
    Pages 111-118
  15. Josep M. Campanera, Xavier Barril, F. Javier Luque
    Pages 119-132
  16. Carlos Randino, Marc Nadal-Ferret, Ricard Gelabert, Miquel Moreno, José M. Lluch
    Pages 133-141
  17. Ryusuke Futamura, Miguel Jorge, José R. B. Gomes
    Pages 167-176

About this book

Introduction

This volume collects research findings presented at the 8th Edition of the Electronic Structure: Principles and Applications (ESPA-2012) International Conference, held in Barcelona, Spain on June 26-29, 2012. The contributions cover research work on methods and fundamentals of theoretical chemistry, chemical reactivity, bimolecular modeling, and materials science. Originally published in the journal Theoretical Chemistry Accounts, these outstanding papers are now available in a hardcover print format, as well as a special electronic edition. This volume provides valuable content for all researchers in theoretical chemistry, and will especially benefit those research groups and libraries with limited access to the journal.

Keywords

Density Functional Theory Hybrid DFT Functional Nonresonant Dynamic Stark Effect Pure DFT Functional Time-dependent DFT Studies Time-dependent Molecular Dynamics Studies

Editors and affiliations

  • Juan J. Novoa
    • 1
  • Manuel F. Ruiz López
    • 2
  1. 1.Facultat de Química Dept. de Química Física & IQTCUBUniversitat de BarcelonaBarcelonaSpain
  2. 2.SRSMC, Theoret. Chemistry and Biochem. GroupUniversity of LorraineVandoeuvre-les-NancyFrance

Bibliographic information

  • DOI https://doi.org/10.1007/978-3-642-41272-1
  • Copyright Information Springer-Verlag Berlin Heidelberg 2014
  • Publisher Name Springer, Berlin, Heidelberg
  • eBook Packages Chemistry and Materials Science
  • Print ISBN 978-3-642-41271-4
  • Online ISBN 978-3-642-41272-1
  • Series Print ISSN 2194-8666
  • Series Online ISSN 2194-8674
  • About this book
Industry Sectors
Chemical Manufacturing
Biotechnology
Pharma