Computational Sciences
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Edited by:
Ponnadurai Ramasami
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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
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.
Topics
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vii |
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xi |
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R.O. Ocaya and J.J. Terblans Requires Authentication Unlicensed Licensed |
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Suman Chowdhury, Arka Bandyopadhyay, Namrata Dhar and Debnarayan Jana Requires Authentication Unlicensed Licensed |
23 |
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Toufik Khairat, Mohammed Salah, Khadija Marakchi and Najia Komiha Requires Authentication Unlicensed Licensed |
71 |
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Jayvant Patade and Sachin Bhalekar Requires Authentication Unlicensed Licensed |
93 |
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M. Alcolea Palafox Requires Authentication Unlicensed Licensed |
117 |
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K. Gbayo, C. Isanbor, K. Lobb and O. Oloba-Whenu Requires Authentication Unlicensed Licensed |
153 |
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Sutapa Biswas Majee and Gopa Roy Biswas Requires Authentication Unlicensed Licensed |
163 |
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Prabhat Ranjan, Tanmoy Chakraborty and Ajay Kumar Requires Authentication Unlicensed Licensed |
173 |
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N Chooramun, P. J. Lawrence and E. R. Galea Requires Authentication Unlicensed Licensed |
191 |
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Emildo Marcano Requires Authentication Unlicensed Licensed |
205 |
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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 Requires Authentication Unlicensed Licensed |
219 |
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229 |
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