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Proceedings of the International Conference on Applied Sciences and Engineering (ICASE 2023)
This is an open access book. We kindly welcome to all academicians, researchers, scientists, engineers and graduate students in the related fields to submit their original research papers. Applications in engineering science that require expertise in mathematics, physics and chemistry. Its mission is to become a voice of the applied science community, addressing researchers and practitioners in different areas ranging from mathematics, physics, and chemistry to all related braches of the engineering, presenting verifiable computational methods, findings, and solutions. The Conference provided a setting for discussing recent developments in various engineering and applied science topics, incl...
Fundamentals and Practice in Statistical Thermodynamics, Solutions Manual
This is a solutions manual to accompany Fundamentals and Practice in Statistical Thermodynamics This textbook supplements, modernizes, and updates thermodynamics courses for both advanced undergraduates and graduate students by introducing the contemporary topics of statistical mechanics such as molecular simulation and liquid-state methods with a variety of realistic examples from the emerging areas of chemical and materials engineering. Current curriculum does not provide the necessary preparations required for a comprehensive understanding of these powerful tools for engineering applications. This text presents not only the fundamental ideas but also theoretical developments in molecular simulation and analytical methods to engineering students by illustrating why these topics are of pressing interest in modern high-tech applications.
Advances in Quantum Chemistry
Advances in Quantum Chemistry, Volume 77, presents surveys of current topics in this rapidly developing field, one that has emerged at the cross section of the historically established areas of mathematics, physics, chemistry and biology. It features detailed reviews written by leading international researchers, with this release focusing on topics such as Per-Olov Löwdin's Impact on a 'Lost Son', Electron impact ionization cross sections for inner L- and M-subshells of atomic targets at relativistic energies, Aromaticity Revisited, Electron-atom and electron-molecule resonances, Precise Born-Oppenheimer potentials of the excited states of H_2 using explicitly correlated exponential functions, and more. - Presents surveys of current topics in this rapidly-developing field that has emerged at the cross section of the historically established areas of mathematics, physics, chemistry and biology - Features detailed reviews written by leading international researchers
Annual Reports in Computational Chemistry
Annual Reports in Computational Chemistry, Volume 13 provides timely and critical reviews of important topics in computational chemistry. Topics in this new release include chapters on the Quantum Chemical Model for Molecular Properties and Processes at the Extreme High Pressure, a section on Interpreting Bonding and Spectra with Correlated, One-Electron Concepts from Electron Propagator Theory, Benchmark databases of intermolecular interaction energies: design, construction, and significance, Gaussian Accelerated Molecular Dynamics: Theory, Implementation and Applications, and Dissociation in Binary Acid/Base Clusters: An Examination of Inconsistencies Introduced into the Many-Body Expansio...
A Snapshot of Molecular Electronic Structure Theory and its Applications
A Snapshot of Molecular Electronic Structure Theory and its Applications, Volume 92 in the Advances in Quantum Chemistry series, highlights new advances in the field, with this new volume presenting interesting chapters on topics such as Polynomial expression of variable precision of molecular integrals for orbital exponents and atomic distances over STO, A first step towards the development of exchange-correlation functionals from X-ray diffraction data, Quantum Mechanical Insights into the Properties of Graphene-like Zinc Oxide (g-ZnO), Theoretical study of structural aspects and interactions between Ederavone and Cucurbit(7)uril, Time dependent potential models for atomic spectroscopy in ...
The 10th International Conference on Materials Science
Selected peer-reviewed extended articles based on abstracts presented at the 10th International Conference on Materials Science (ICMS-2021) Aggregated Book
