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Computational Quantum Chemistry
  • Language: en
  • Pages: 252

Computational Quantum Chemistry

Computational Quantum Chemistry presents computational electronic structure theory as practised in terms of ab initio waveform methods and density functional approaches. Getting a full grasp of the field can often prove difficult, since essential topics fall outside of the scope of conventional chemistry education. This professional reference book provides a comprehensive introduction to the field. Postgraduate students and experienced researchers alike will appreciate Joseph McDouall's engaging writing style. The book is divided into five chapters, each providing a major aspect of the field. Electronic structure methods, the computation of molecular properties, methods for analysing the output from computations and the importance of relativistic effects on molecular properties are also discussed. Links to the websites of widely used software packages are provided so that the reader can gain first hand experience of using the techniques described in the book.

Valence Bond Theory
  • Language: en
  • Pages: 837

Valence Bond Theory

  • Type: Book
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  • Published: 2002-06-05
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  • Publisher: Elsevier

Valence bond (VB) theory, which builds the descriptions of molecules from those of its constituent parts, provided the first successful quantum mechanical treatments of chemical bonding. Its language and concepts permeate much of chemistry, at all levels. Various modern formulations of VB theory represent serious tools for quantum chemical studies of molecular electronic structure and reactivity. In physics, there is much VB-based work (particularly in semi-empirical form) on larger systems. Importance of TopicThe last decade has seen significant advances in methodology and a vast increase in the range of applications, with many new researchers entering the field.Why This TitleValence Bond Theory succeeds in presenting a comprehensive selection of contributions from leading valence bond (VB) theory researchers throughout the world. It focuses on the vast increase in the range of applications of methodology based on VB theory during the last decade and especially emphasizes recent advances.

Official Register of the United States
  • Language: en
  • Pages: 1718

Official Register of the United States

  • Type: Book
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  • Published: 1903
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  • Publisher: Unknown

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Register of Officers and Agents, Civil, Military and Naval [etc]
  • Language: en
  • Pages: 1498

Register of Officers and Agents, Civil, Military and Naval [etc]

  • Type: Book
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  • Published: 1897
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  • Publisher: Unknown

None

Congressional Record
  • Language: en
  • Pages: 1468

Congressional Record

  • Categories: Law
  • Type: Book
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  • Published: 1970
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  • Publisher: Unknown

The Congressional Record is the official record of the proceedings and debates of the United States Congress. It is published daily when Congress is in session. The Congressional Record began publication in 1873. Debates for sessions prior to 1873 are recorded in The Debates and Proceedings in the Congress of the United States (1789-1824), the Register of Debates in Congress (1824-1837), and the Congressional Globe (1833-1873)

Index to New York in the Spanish-American war
  • Language: en
  • Pages: 456

Index to New York in the Spanish-American war

Index to New York in the Spanish-American war

Register of Retired Commissioned and Warrant Officers, Regular and Reserve, of the United States Navy
  • Language: en
  • Pages: 832
Scobie's Canadian Almanac, and Repository of Useful Knowledge
  • Language: en
  • Pages: 204

Scobie's Canadian Almanac, and Repository of Useful Knowledge

  • Type: Book
  • -
  • Published: 1853
  • -
  • Publisher: Unknown

None

Index of Patents Issued from the United States Patent and Trademark Office
  • Language: en
  • Pages: 1948

Index of Patents Issued from the United States Patent and Trademark Office

  • Type: Book
  • -
  • Published: 1993
  • -
  • Publisher: Unknown

None

Bi-centennial History of Albany
  • Language: en
  • Pages: 1450

Bi-centennial History of Albany

  • Type: Book
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  • Published: 1886
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  • Publisher: Unknown

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