Experimental and Theoretical Studies of Molecular Complexes

Experimental and Theoretical Studies of Molecular Complexes PDF Author: Maganthran Ganesan Govender
Publisher:
ISBN:
Category : Complex compounds
Languages : en
Pages : 960

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Experimental and Theoretical Studies of Molecular Complexes

Experimental and Theoretical Studies of Molecular Complexes PDF Author: Maganthran Ganesan Govender
Publisher:
ISBN:
Category : Complex compounds
Languages : en
Pages : 960

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Experimental and Theoretical Studies on Molecular Complexes

Experimental and Theoretical Studies on Molecular Complexes PDF Author: Roger S. Storm
Publisher:
ISBN:
Category :
Languages : en
Pages : 326

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Experimental and Theoretical Studies on Small Singly and Doubly Charged Molecular Ions and Ionic Complexes

Experimental and Theoretical Studies on Small Singly and Doubly Charged Molecular Ions and Ionic Complexes PDF Author: Frederick R. Bennett
Publisher:
ISBN:
Category :
Languages : en
Pages : 142

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Theoretical studies for various molecular complexes and their interactions

Theoretical studies for various molecular complexes and their interactions PDF Author:
Publisher:
ISBN:
Category :
Languages : en
Pages :

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Experimental and Theoretical Studies of Molecular Solids

Experimental and Theoretical Studies of Molecular Solids PDF Author:
Publisher:
ISBN:
Category :
Languages : en
Pages : 13

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Work over a three year period on the optical and dielectric properties of a sequence of ionic molecular solids such as K2SeO4, KNO, and NaNO2 is described. This work had both experimental and theoretical components. Principally the experiments used light scattering and birefringence to monitor structural and optical changes associated with solid-solid phase transitions. Theoretical studies concentrated on developing a unified theory of the ionic interactions in these systems which resulted in parameter free molecular dynamics simulations which closely reproduced the observed transition and structural behavior of these increasingly complex systems. Ferroelectrics, Phase, Transitions, Ionic, Molecular, Solids.

Complexity in Chemistry and Beyond: Interplay Theory and Experiment

Complexity in Chemistry and Beyond: Interplay Theory and Experiment PDF Author: Craig Hill
Publisher: Springer
ISBN: 9400755481
Category : Science
Languages : en
Pages : 247

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Book Description
Complexity occurs in biological and synthetic systems alike. This general phenomenon has been addressed in recent publications by investigators in disciplines ranging from chemistry and biology to psychology and philosophy. Studies of complexity for molecular scientists have focussed on breaking symmetry, dissipative processes, and emergence. Investigators in the social and medical sciences have focused on neurophenomenology, cognitive approaches and self-consciousness. Complexity in both structure and function is inherent in many scientific disciplines of current significance and also in technologies of current importance that are rapidly evolving to address global societal needs. Several of these multifaceted scientific disciplines are addressed in this book including complexity from the general and philosophical perspective, magnetic phenomena, control of self assembly and function in large multicomponent clusters, application of theory to probe structure and mechanism in highly complex molecular species, and the design of multifunctional nanoscale molecules of value in decontamination and solar fuels research. Each chapter is both a review and addresses some ongoing challenges, thus each should provide a good preparation for further work in these highly active areas of research endeavour.

Theoretical Studies of Molecular Recognition

Theoretical Studies of Molecular Recognition PDF Author: Natasja Brooijmans
Publisher:
ISBN:
Category : Binding sites (Biochemistry)
Languages : en
Pages : 510

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Experimental and Theoretical Studies of Inorganic Reactions: Part 1 - Studies of the Ligand Exchange Reactions of Cobalt(ii) Complexes by Nuclear Magnetic Resonance Techniques. Part 2 - Molecular Orbital Studies of the Trans Influence Phenomenon and the Kinetic Trans Effect Inplatinum(ii) Complexes

Experimental and Theoretical Studies of Inorganic Reactions: Part 1 - Studies of the Ligand Exchange Reactions of Cobalt(ii) Complexes by Nuclear Magnetic Resonance Techniques. Part 2 - Molecular Orbital Studies of the Trans Influence Phenomenon and the Kinetic Trans Effect Inplatinum(ii) Complexes PDF Author:
Publisher:
ISBN:
Category :
Languages : en
Pages :

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Theory of Atomic and Molecular Clusters

Theory of Atomic and Molecular Clusters PDF Author: Julius Jellinek
Publisher: Springer Science & Business Media
ISBN: 364258389X
Category : Science
Languages : en
Pages : 438

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Book Description
The emergence and spectacularly rapid evolution of the field of atomic and molecular clusters are among the most exciting developments in the recent history of natural sciences. The field of clusters expands into the traditional disciplines of physics, chemistry, materials science, and biology, yet in many respects it forms a cognition area of its own. This book presents a cross section of theoretical approaches and their applications in studies of different cluster systems. The contributions are written by experts in the respective areas. The systems discussed range from weakly (van der Waals) bonded, through hydrogen- and covalently bonded, to semiconductor and metallic clusters. The theoretical approaches involve high-level electronic structure computations, more approximate electronic structure treatments, use of semiempirical potentials, dynamical and statistical analyses, and illustrate the utility of both classical and quantum mechanical concepts.

Experimental and Theoretical Approaches to Actinide Chemistry

Experimental and Theoretical Approaches to Actinide Chemistry PDF Author: John K. Gibson
Publisher: John Wiley & Sons
ISBN: 1119115531
Category : Science
Languages : en
Pages : 538

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Book Description
A review of contemporary actinide research that focuses on new advances in experiment and theory, and the interplay between these two realms Experimental and Theoretical Approaches to Actinide Chemistry offers a comprehensive review of the key aspects of actinide research. Written by noted experts in the field, the text includes information on new advances in experiment and theory and reveals the interplay between these two realms. The authors offer a multidisciplinary and multimodal approach to the nature of actinide chemistry, and explore the interplay between multiple experiments and theory, as well as between basic and applied actinide chemistry. The text covers the basic science used in contemporary studies of the actinide systems, from basic synthesis to state-of-the-art spectroscopic and computational techniques. The authors provide contemporary overviews of each topic area presented and describe the current and anticipated experimental approaches for the field, as well as the current and future computational chemistry and materials techniques. In addition, the authors explore the combination of experiment and theory. This important resource: Provides an essential resource the reviews the key aspects of contemporary actinide research Includes information on new advances in experiment and theory, and the interplay between the two Covers the basic science used in contemporary studies of the actinide systems, from basic synthesis to state-of-the-art spectroscopic and computational techniques Focuses on the interplay between multiple experiments and theory, as well as between basic and applied actinide chemistry Written for academics, students, professionals and researchers, this vital text contains a thorough review of the key aspects of actinide research and explores the most recent advances in experiment and theory.