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Computational Modelling Of Molecular Nanomagnets


Computational Modelling Of Molecular Nanomagnets
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Computational Modelling Of Molecular Nanomagnets


Computational Modelling Of Molecular Nanomagnets
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Author : Gopalan Rajaraman
language : en
Publisher: Springer Nature
Release Date :

Computational Modelling Of Molecular Nanomagnets written by Gopalan Rajaraman and has been published by Springer Nature this book supported file pdf, txt, epub, kindle and other format this book has been release on with categories.




Molecular Nanomagnets And Related Phenomena


Molecular Nanomagnets And Related Phenomena
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Author : Song Gao
language : en
Publisher: Springer
Release Date : 2015-02-20

Molecular Nanomagnets And Related Phenomena written by Song Gao and has been published by Springer this book supported file pdf, txt, epub, kindle and other format this book has been release on 2015-02-20 with Science categories.


The series Structure and Bonding publishes critical reviews on topics of research concerned with chemical structure and bonding. The scope of the series spans the entire Periodic Table and addresses structure and bonding issues associated with all of the elements. It also focuses attention on new and developing areas of modern structural and theoretical chemistry such as nanostructures, molecular electronics, designed molecular solids, surfaces, metal clusters and supramolecular structures. Physical and spectroscopic techniques used to determine, examine and model structures fall within the purview of Structure and Bonding to the extent that the focus is on the scientific results obtained and not on specialist information concerning the techniques themselves. Issues associated with the development of bonding models and generalizations that illuminate the reactivity pathways and rates of chemical processes are also relevant. The individual volumes in the series are thematic. The goal of each volume is to give the reader, whether at a university or in industry, a comprehensive overview of an area where new insights are emerging that are of interest to a larger scientific audience. Thus each review within the volume critically surveys one aspect of that topic and places it within the context of the volume as a whole. The most significant developments of the last 5 to 10 years should be presented using selected examples to illustrate the principles discussed. A description of the physical basis of the experimental techniques that have been used to provide the primary data may also be appropriate, if it has not been covered in detail elsewhere. The coverage need not be exhaustive in data, but should rather be conceptual, concentrating on the new principles being developed that will allow the reader, who is not a specialist in the area covered, to understand the data presented. Discussion of possible future research directions in the area is welcomed. Review articles for the individual volumes are invited by the volume editors. Readership: research scientists at universities or in industry, graduate students Special offer for all customers who have a standing order to the print version of Structure and Bonding, we offer free access to the electronic volumes of the Series published in the current year via SpringerLink.



Molecular Nanomagnets


Molecular Nanomagnets
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Author : Heike C. Herper
language : en
Publisher: Springer Nature
Release Date : 2020-03-28

Molecular Nanomagnets written by Heike C. Herper and has been published by Springer Nature this book supported file pdf, txt, epub, kindle and other format this book has been release on 2020-03-28 with Technology & Engineering categories.


This book focuses on 3d transition metal centered phthalocyanine molecules and their deposition on different substrates. Phthalocyanines are an ideal prototype since they can be grown flat on many surfaces. It highlights the molecule-substrate interaction and its influence on the magnetic and spectroscopic properties of the molecules as well as the influence of ligands — reviewing both experiential and theoretical data. Since experimental setups differ and approximations in theory vary and can influence the result, a substantial part is dedicated to a thorough discussion of the different experimental and computational methods from the point of view of reliability and predictive power.



Molecular Nanomagnets


Molecular Nanomagnets
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Author : Dante Gatteschi
language : en
Publisher: OUP Oxford
Release Date : 2011-04-14

Molecular Nanomagnets written by Dante Gatteschi and has been published by OUP Oxford this book supported file pdf, txt, epub, kindle and other format this book has been release on 2011-04-14 with Science categories.


Nanomagnetism is a rapidly expanding area of research which appears to be able to provide novel applications. Magnetic molecules are at the very bottom of the possible size of nanomagnets and they provide a unique opportunity to observe the coexistence of classical and quantum properties. The discovery in the early 90's that a cluster comprising twelve manganese ions shows hysteresis of molecular origin, and later proved evidence of quantum effects, opened a new research area which is still flourishing through the collaboration of chemists and physicists. This book is the first attempt to cover in detail the new area of molecular nanomagnetism, for which no other book is available. In fact research and review articles, and book chapters are the only tools available for newcomers and the experts in the field. It is written by the chemists originators and by a theorist who has been one of the protagonists of the development of the field, and is explicitly addressed to an audience of chemists and physicists, aiming to use a language suitable for the two communities.



Molecular Cluster Magnets


Molecular Cluster Magnets
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Author : Richard Winpenny
language : en
Publisher: World Scientific
Release Date : 2012

Molecular Cluster Magnets written by Richard Winpenny and has been published by World Scientific this book supported file pdf, txt, epub, kindle and other format this book has been release on 2012 with Science categories.


This work covers new developments in the field of molecular nanomagnetism, complementing previous books in this area (for example the volume by Gatteschi, Sessoli and Villain on Single Molecule Magnets). The book is written by experts in the field and is intended as a compilation of critical reviews of new areas rather than a comprehensive text.



Rational Design And Modelling Of F Block Molecular Nanomagnets


Rational Design And Modelling Of F Block Molecular Nanomagnets
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Author : José Jaime Baldoví Jachán
language : en
Publisher:
Release Date : 2016

Rational Design And Modelling Of F Block Molecular Nanomagnets written by José Jaime Baldoví Jachán and has been published by this book supported file pdf, txt, epub, kindle and other format this book has been release on 2016 with categories.




Computational Nanotechnology


Computational Nanotechnology
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Author : Sarhan M. Musa
language : en
Publisher: CRC Press
Release Date : 2011-07-26

Computational Nanotechnology written by Sarhan M. Musa and has been published by CRC Press this book supported file pdf, txt, epub, kindle and other format this book has been release on 2011-07-26 with Science categories.


Applications of nanotechnology continue to fuel significant innovations in areas ranging from electronics, microcomputing, and biotechnology to medicine, consumer supplies, aerospace, and energy production. As progress in nanoscale science and engineering leads to the continued development of advanced materials and new devices, improved methods of modeling and simulation are required to achieve a more robust quantitative understanding of matter at the nanoscale. Computational Nanotechnology: Modeling and Applications with MATLAB® provides expert insights into current and emerging methods, opportunities, and challenges associated with the computational techniques involved in nanoscale research. Written by, and for, those working in the interdisciplinary fields that comprise nanotechnology—including engineering, physics, chemistry, biology, and medicine—this book covers a broad spectrum of technical information, research ideas, and practical knowledge. It presents an introduction to computational methods in nanotechnology, including a closer look at the theory and modeling of two important nanoscale systems: molecular magnets and semiconductor quantum dots. Topics covered include: Modeling of nanoparticles and complex nano and MEMS systems Theory associated with micromagnetics Surface modeling of thin films Computational techniques used to validate hypotheses that may not be accessible through traditional experimentation Simulation methods for various nanotubes and modeling of carbon nanotube and silicon nanowire transistors In regard to applications of computational nanotechnology in biology, contributors describe tracking of nanoscale structures in cells, effects of various forces on cellular behavior, and use of protein-coated gold nanoparticles to better understand protein-associated nanomaterials. Emphasizing the importance of MATLAB for biological simulations in nanomedicine, this wide-ranging survey of computational nanotechnology concludes by discussing future directions in the field, highlighting the importance of the algorithms, modeling software, and computational tools in the development of efficient nanoscale systems.



Molecular Nanomagnets With Switchable Coupling For Quantum Simulation


Molecular Nanomagnets With Switchable Coupling For Quantum Simulation
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Author :
language : en
Publisher:
Release Date : 2014

Molecular Nanomagnets With Switchable Coupling For Quantum Simulation written by and has been published by this book supported file pdf, txt, epub, kindle and other format this book has been release on 2014 with categories.


Molecular nanomagnets are attractive candidate qubits because of their wide inter- and intra-molecular tunability. Uniform magnetic pulses could be exploited to implement one- and two-qubit gates in presence of a properly engineered pattern of interactions, but the synthesis of suitable and potentially scalable supramolecular complexes has proven a very hard task. Indeed, no quantum algorithms have ever been implemented, not even a proof-of-principle two-qubit gate. In this paper we show that the magnetic couplings in two supramolecular {Cr7Ni}-Ni-{Cr7Ni} assemblies can be chemically engineered to fit the above requisites for conditional gates with no need of local control. Microscopic parameters are determined by a recently developed many-body ab-initio approach and used to simulate quantum gates. We find that these systems are optimal for proof-of-principle two-qubit experiments and can be exploited as building blocks of scalable architectures for quantum simulation.



Parallel Processing And Applied Mathematics


Parallel Processing And Applied Mathematics
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Author : Roman Wyrzykowski
language : en
Publisher: Springer
Release Date : 2018-03-22

Parallel Processing And Applied Mathematics written by Roman Wyrzykowski and has been published by Springer this book supported file pdf, txt, epub, kindle and other format this book has been release on 2018-03-22 with Computers categories.


The two-volume set LNCS 10777 and 10778 constitutes revised selected papers from the 12th International Conference on Parallel Processing and Applied Mathematics, PPAM 2017, held in Lublin, Poland, in September 2017. The 49 regular papers presented in the proceedings were selected from 98 submissions. For the workshops and special sessions, that were held as integral parts of the PPAM 2017 conference, a total of 51 papers was accepted from 75 submissions. The papers were organized in topical sections named as follows: Part I: numerical algorithms and parallel scientific computing; particle methods in simulations; task-based paradigm of parallel computing; GPU computing; parallel non-numerical algorithms; performance evaluation of parallel algorithms and applications; environments and frameworks for parallel/distributed/cloud computing; applications of parallel computing; soft computing with applications; and special session on parallel matrix factorizations. Part II: workshop on models, algorithms and methodologies for hybrid parallelism in new HPC systems; workshop power and energy aspects of computations (PEAC 2017); workshop on scheduling for parallel computing (SPC 2017); workshop on language-based parallel programming models (WLPP 2017); workshop on PGAS programming; minisymposium on HPC applications in physical sciences; minisymposium on high performance computing interval methods; workshop on complex collective systems.



Nanoscience And Computational Chemistry


Nanoscience And Computational Chemistry
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Author : Andrew G. Mercader
language : en
Publisher: CRC Press
Release Date : 2013-11-23

Nanoscience And Computational Chemistry written by Andrew G. Mercader and has been published by CRC Press this book supported file pdf, txt, epub, kindle and other format this book has been release on 2013-11-23 with Science categories.


This book provides innovative chapters covering new methodologies and important applications in the fields of nanoscience and computational chemistry. The book offers scope for academics, researchers, and engineering professionals to present their research and development works that have potential for applications in several disciplines of nano and