Results 221 to 230 of about 251,313 (260)
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Theoretical chemistry

1991
Ab initio Molecular Orbital and Valence-Bond methods and the semiempidcal, AM1 method are applied in the studies of: 1. The proton affinity of diacetylene The gas-phase ion-molecule reaction between diacetylene and a proton was studied theoretically at the MP4SDQ/6-311G** level. The geometries, calculated harmonic vibrational frequencies and the proton
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Theoretical Chemistry

1974
Specialist Periodical Reports provide systematic and detailed review coverage of progress in the major areas of chemical research. Written by experts in their specialist fields the series creates a unique service for the active research chemist, supplying regular critical in-depth accounts of progress in particular areas of chemistry. For over 90 years
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Theoretical Aspects of Communication in Chemistry

Angewandte Chemie International Edition in English, 1970
AbstractSuccessful searching for publications on the basis of subject obeys rules whose relations to thermodynamics are unmistakable. As a collection of literature grows, the degree of order required increases, since the patience, time, and memory used by man to compensate for lack of order cannot keep pace. The high degrees of order that are necessary
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Theoretical organmetallic chemistry

2000
M. Green, S. A. Macgregor
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Graph-Theoretical Matrices in Chemistry

2007
Graph-Theoretical Matrices in Chemistry presents a systematic survey of graph-theoretical matrices and highlights their potential uses. This comprehensive volume is an updated, extended version of a former bestseller featuring a series of mathematical chemistry monographs. In this edition, nearly 200 graph-theoretical matrices are included. This second
Trinajstić, Nenad   +2 more
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Combustion chemistry in the twenty-first century: Developing theory-informed chemical kinetics models

Progress in Energy and Combustion Science, 2021
James A Miller   +2 more
exaly  

Density functional theory

Coordination Chemistry Reviews, 1998
Henry Chermette
exaly  

Theoretical Chemistry.

The Journal of Physical Chemistry, 1946
Samuel Glasstone, Bryce L. Crawford
openaire   +1 more source

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