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Theoretical chemistry information


Jacobus van 't Hoff (1852–1911), an influential theoretical chemist and the first winner of the Nobel Prize in Chemistry.

Theoretical chemistry is the branch of chemistry which develops theoretical generalizations that are part of the theoretical arsenal of modern chemistry: for example, the concepts of chemical bonding, chemical reaction, valence, the surface of potential energy, molecular orbitals, orbital interactions, and molecule activation.

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Theoretical chemistry

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Theoretical chemistry is the branch of chemistry which develops theoretical generalizations that are part of the theoretical arsenal of modern chemistry:...

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Outline of chemistry

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equations. It is usually associated with quantum chemistry and theoretical chemistry. Physical chemistry is a distinct discipline from chemical physics...

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Chemistry

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equations. It is usually associated with quantum chemistry and theoretical chemistry. Physical chemistry is a distinct discipline from chemical physics...

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Computational and Theoretical Chemistry

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Computational and Theoretical Chemistry is a peer-reviewed scientific journal published by Elsevier. It was established in 1985 as Journal of Molecular...

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Quantum chemistry

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quantum-mechanical basis into a new theoretical framework. Many chemists were introduced to the field of quantum chemistry by Pauling's 1939 text The Nature...

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Computational chemistry

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Computational chemistry is a branch of chemistry that uses computer simulations to assist in solving chemical problems. It uses methods of theoretical chemistry incorporated...

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Chemist

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nuclear chemistry, organic chemistry, inorganic chemistry, polymer chemistry, analytical chemistry, physical chemistry, theoretical chemistry, quantum...

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Mathematical chemistry

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Mathematical chemistry is the area of research engaged in novel applications of mathematics to chemistry; it concerns itself principally with the mathematical...

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Theoretical Chemistry Accounts

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research and review articles in theoretical chemistry, physical chemistry, quantum chemistry, and computational chemistry. It was founded in 1962 as Theoretica...

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World Association of Theoretical and Computational Chemists

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development and application of theoretical methods" in chemistry, particularly theoretical chemistry and computational chemistry. It was originally called...

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Relativistic quantum chemistry

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Relativistic quantum chemistry combines relativistic mechanics with quantum chemistry to calculate elemental properties and structure, especially for the...

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Quantum biology

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Quantum biology is the study of applications of quantum mechanics and theoretical chemistry to aspects of biology that cannot be accurately described by the...

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Joachim Sauer

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a German quantum chemist and professor emeritus of physical and theoretical chemistry at the Humboldt University of Berlin. He is the husband of the former...

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Lars Onsager

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and theoretical physicist. He held the Gibbs Professorship of Theoretical Chemistry at Yale University. He was awarded the Nobel Prize in Chemistry in...

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Theoretical astronomy

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Theoretical astronomy is the use of analytical and computational models based on principles from physics and chemistry to describe and explain astronomical...

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List of important publications in chemistry

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This is a list of important publications in chemistry, organized by field. Some factors that correlate with publication notability include: Topic creator...

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Ab initio quantum chemistry methods

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quantum chemistry methods are computational chemistry methods based on quantum chemistry. The term ab initio was first used in quantum chemistry by Robert...

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John Humphrey Plummer Professor

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The John Humphrey Plummer Professorships were established in 1931 from a bequest of £200,000 under the will of John Humphrey Plummer, an estate agent of...

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Centre for Theoretical and Computational Chemistry

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The Centre for Theoretical and Computational Chemistry (CTCC) was founded by the Norwegian Research Council in 2007. The duration of the project is ten...

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Isostere

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Silverman, The Organic Chemistry of Drug Design and Drug Action, Second Edition, 2004 Nathan Brown. Bioisosteres in Medicinal Chemistry. Wiley-VCH, 2012, p...

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Max Planck Institute for Coal Research

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in organic and organometallic chemistry, in homogeneous and heterogeneous catalysis as well as in theoretical chemistry. The principal aim is to develop...

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