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Quantum Chemistry and Dynamics of Excited States

undergraduate students, Quantum Chemistry and Dynamics of Excited States: Methods and Applications reports the most updated and accurate theoretical;

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Multiconfigurational Quantum Chemistry

in ground and excited states, transition metal and other heavy element systems. The authors detail the drawbacks and limitations of DFT and coupled;

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Theoretical Chemistry for Electronic Excited States

, and non-adiabatic dynamics, have been brought together into one volume. Theoretical Chemistry for Electronic Excited States is aimed at both;

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Modern Quantum Chemistry

deals with the study of ground state of individual molecules and atoms as well as the transition and excited states that occur during chemical;

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Structure and Dynamics of Atoms and Molecules

represented by an article about the quantum dynamics of diatoms in external fields. A view of certain atomic excited states is presented in a paper on;

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Concepts and Methods in Modern Theoretical Chemistry

learn how concepts from ab initio quantum chemistry, density functional theory (DFT), and molecular simulation can be used to describe;

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Highly Excited Molecules

Integrating both theoretical and experimental approaches, this unique book examines transition states and chemical reactivity, and will be;

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Photochemistry

This book offers an introduction to photochemistry for students with a minimal background in physical chemistry and molecular quantum;

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Photochemistry

This book offers an introduction to photochemistry for students with a minimal background in physical chemistry and molecular quantum;

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Polaritonic Chemistry

. This thesis builds on the foundations of chemistry and quantum electrodynamics in order to provide a theoretical framework to describe these;

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Polaritonic Chemistry

. This thesis builds on the foundations of chemistry and quantum electrodynamics in order to provide a theoretical framework to describe these;

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Advances in Quantum Systems Research

foundation for modern physics. The principles of quantum physics are being applied in several areas such as quantum computing and quantum chemistry;

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Contemporary Research in Quantum Systems

foundation for modern physics. The principles of quantum physics are being applied in several areas such as quantum computing and quantum chemistry;

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Reviews of Reactive Intermediate Chemistry

The chemistry of reactive intermediates is central to a modern mechanistic and quantitative understanding of organic chemistry. Moreover;

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Theoretical Organic Chemistry

topics devoted to quantum chemistry, physical properties of organic compounds, their reactivity, their biological activity, and their excited;

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Advances in Quantum Chemistry

-molecule resonances, Precise Born-Oppenheimer potentials of the excited states of H_2 using explicitly correlated exponential functions, and more;

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Introduction to Computational Chemistry

extensive DFT functionals, excited states and time dependent molecular properties * Accelerated Molecular Dynamics methods * Tensor decomposition;

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Reviews in Computational Chemistry, Volume 14

THIS VOLUME, WHICH IS DESIGNED FOR STAND-ALONE USE IN TEACHING AND RESEARCH, FOCUSES ON QUANTUM CHEMISTRY, AN AREA OF SCIENCE THAT MANY;

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Quantum Dynamics

between what is traditionally taught in a one-semester quantum chemistry course and the modern field of chemical dynamics, presenting the quantum;

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Quantum Dynamics

between what is traditionally taught in a one-semester quantum chemistry course and the modern field of chemical dynamics, presenting the quantum;

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Quantum Boundaries of Life

field that have emerged at the cross section of mathematics, physics, chemistry and biology. Topics covered include Quantum Considerations;

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Electron Dynamics In Molecular Interactions

rapidly expanding segment of molecular quantum dynamics. Emphasis is placed on describing and interpreting transitions between electronic states;

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Applications of Quantum Dynamics in Chemistry

molecule are treated with quantum mechanical calculations. This volume of Lecture Notes in Chemistry addresses graduate students and postdocs;

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Advances in Methods and Applications of Quantum Systems in Chemistry, Physics, and Biology

, relativistic and correlation effects in quantum chemistry, topics of computational chemistry, physics and biology, as well as applications;

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Conceptual Perspectives in Quantum Chemistry

symmetries in quantum mechanics; the interplay between quantum chemistry and molecular dynamics simulations; the permutation group in many-electron;

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A Single Trapped Rydberg Ion

-sensitive Rydberg ion are studied. After mitigating unwanted trap effects, the ion is coherently excited to Rydberg states and a quantum gate;

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A Single Trapped Rydberg Ion

-sensitive Rydberg ion are studied. After mitigating unwanted trap effects, the ion is coherently excited to Rydberg states and a quantum gate;

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