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Computational Sciences

  • Edited by: Ponnadurai Ramasami
  • With contributions by: Mauricio Alcolea Palafox , Bandyopadhyay Akra , Sachin Bhalekar , Sutapa Biswas Majee , Nitish Chooramun , Suman Chowdhury , Debnarayan Jana , Namrata Dhar , Ed Galea , K Gbayo , Majdi Hochlaf , Toufik Khairat , Najia Komiha , Peter Lawrence , Roberto Linguerri , K. Lobb , Khadija Marakchi , Richard Ocaya , Jayvant Patade , Mohammed Salah , Emildo Marcano , Udo Schwingenschlögl and TANMOY CHAKRABORTY
Language: English
Published/Copyright: 2017
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About this book

Eleven carefully selected, peer-reviewed contributions from the Virtual Conference on Computational Science (VCCS-2016) are featured in this edited book of proceedings. VCCS-2016, an annual meeting, was held online from 1st to 31st August 2016. The theme of the conference was "Computational Thinking for the Advancement of Society" and it matched the paradigm shift in the way we think. VCCS-2016 was attended by 100 participants from 20 countries. The chapters reflect a wide range of fundamental and applied research applying computational methods.

  • Providing a thorough overview on computational sciences.
  • With contributions from the fields of computational chemistry, physics, engineering, etc.

Author / Editor information

Prof Ponnadurai Ramasami, CSci, CChem, FRSC, FICCE, MMast, received his PhD in Physical Chemistry and became full Professor in 2013. He leads the Computational Chemistry Group, Department of Chemistry, Faculty of Science at the University of Mauritius. The research group focuses on the use of computational methods to solve chemistry and interdisciplinary problems. The group is particularly interested to collaborate with experimentalists and try to use computational methods to complement experimental research. He has already published 260 research papers in peer-reviewed journals and he has edited several books. He is the chairman of the annual Virtual Conference on Chemistry and its Applications.


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R.O. Ocaya and J.J. Terblans
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Suman Chowdhury, Arka Bandyopadhyay, Namrata Dhar and Debnarayan Jana
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Toufik Khairat, Mohammed Salah, Khadija Marakchi and Najia Komiha
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Jayvant Patade and Sachin Bhalekar
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M. Alcolea Palafox
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K. Gbayo, C. Isanbor, K. Lobb and O. Oloba-Whenu
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153

Sutapa Biswas Majee and Gopa Roy Biswas
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163

Prabhat Ranjan, Tanmoy Chakraborty and Ajay Kumar
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173

N Chooramun, P. J. Lawrence and E. R. Galea
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191

Emildo Marcano
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205

Udo Schwingenschlögl, Jiajie Zhu, Tetsuya Morishita, Michelle J.S. Spencer, Paola De Padova, Amanda Generosi, Barbara Paci, Carlo Ottaviani, Claudio Quaresima, Bruno Olivieri, Eric Salomon, Thierry Angot, Guy Le Lay, Harold J.W. Zandvliet and L. C. Lew Yan Voon
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Publishing information
Pages and Images/Illustrations in book
eBook published on:
October 23, 2017
eBook ISBN:
9783110467215
Hardcover published on:
October 23, 2017
Hardcover ISBN:
9783110465365
Pages and Images/Illustrations in book
Front matter:
13
Main content:
235
Illustrations:
150
Coloured Illustrations:
75
Tables:
50
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