Theoretical Treatment of Large Molecules and Their Interactions
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Published By Springer Berlin Heidelberg

9783642634956, 9783642581830

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Orbital Interactions and Chemical Reactivity of Metal Particles and Metal Surfaces

Theoretical Treatment of Large Molecules and Their Interactions ◽

10.1007/978-3-642-58183-0_9 ◽

1991 ◽

pp. 323-389 ◽

Author(s):

R. A. van Santen ◽

E. J. Baerends

Keyword(s):

Metal Surfaces ◽

Chemical Reactivity ◽

Metal Particles ◽

Orbital Interactions

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Classical Electrostatics in Molecular Interactions

Theoretical Treatment of Large Molecules and Their Interactions ◽

10.1007/978-3-642-58183-0_4 ◽

1991 ◽

pp. 103-131 ◽

Author(s):

Anthony J. Stone

Keyword(s):

Molecular Interactions

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Semiclassical Methods for Large Molecules of Biological Importance

Theoretical Treatment of Large Molecules and Their Interactions ◽

10.1007/978-3-642-58183-0_2 ◽

1991 ◽

pp. 51-64

Author(s):

Charles L. Brooks

Keyword(s):

Large Molecules ◽

Semiclassical Methods ◽

Biological Importance

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Weak Interactions Between Molecules and Their Physical Interpretation

Theoretical Treatment of Large Molecules and Their Interactions ◽

10.1007/978-3-642-58183-0_5 ◽

1991 ◽

pp. 133-169 ◽

Author(s):

Valerio Magnasco ◽

Roy McWeeny

Keyword(s):

Physical Interpretation ◽

Weak Interactions

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Intermolecular Forces and the Properties of Molecular Solids

Theoretical Treatment of Large Molecules and Their Interactions ◽

10.1007/978-3-642-58183-0_10 ◽

1991 ◽

pp. 391-433

Author(s):

Ad van der Avoird

Keyword(s):

Intermolecular Forces ◽

Molecular Solids

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Electronic Excited States of Biomolecular Systems: Ab Initio FSGO-based Quantum Mechanical Methods with Applications to Photosynthetic and Related Systems

Theoretical Treatment of Large Molecules and Their Interactions ◽

10.1007/978-3-642-58183-0_3 ◽

1991 ◽

pp. 65-102

Author(s):

Gerald M. Maggiora ◽

James D. Petke ◽

Ralph E. Christoffersen

Keyword(s):

Ab Initio ◽

Excited States ◽

Quantum Mechanical ◽

Biomolecular Systems ◽

Electronic Excited States ◽

Mechanical Methods

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Ab Initio Studies of Hydrogen Bonding

Theoretical Treatment of Large Molecules and Their Interactions ◽

10.1007/978-3-642-58183-0_6 ◽

1991 ◽

pp. 171-227

Author(s):

Steve Scheiner

Keyword(s):

Hydrogen Bonding ◽

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Theoretical Evaluation of Solvent Effects

Theoretical Treatment of Large Molecules and Their Interactions ◽

10.1007/978-3-642-58183-0_11 ◽

1991 ◽

pp. 435-458 ◽

Author(s):

O. Tapia

Keyword(s):

Solvent Effects ◽

Theoretical Evaluation

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Curve Crossing Diagrams as General Models for Chemical Reactivity and Structure

Theoretical Treatment of Large Molecules and Their Interactions ◽

10.1007/978-3-642-58183-0_8 ◽

1991 ◽

pp. 269-322

Author(s):

Sason S. Shaik ◽

Philippe C. Hiberty

Keyword(s):

Chemical Reactivity ◽

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The Extramolecular Electrostatic Potential. An Indicator of the Chemical Reactivity

Theoretical Treatment of Large Molecules and Their Interactions ◽

10.1007/978-3-642-58183-0_7 ◽

1991 ◽

pp. 229-268 ◽

Author(s):

Jacopo Tomasi ◽

Rosanna Bonaccorsi ◽

Roberto Cammi

Keyword(s):

Electrostatic Potential ◽

Chemical Reactivity

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