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Molecular Electronic-Structure Theory Book

Molecular Electronic-Structure Theory
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Molecular Electronic-Structure Theory, Ab initio quantum chemistry has emerged as an important tool in chemical research and is appliced to a wide variety of problems in chemistry and molecular physics. Recent developments of computational methods have enabled previously intractable chemical p, Molecular Electronic-Structure Theory
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  • Molecular Electronic-Structure Theory
  • Written by author Trygve Helgaker, Poul Jorgensen, Jeppe Olsen
  • Published by Wiley-Blackwell, 2000/08/11
  • Ab initio quantum chemistry has emerged as an important tool in chemical research and is appliced to a wide variety of problems in chemistry and molecular physics. Recent developments of computational methods have enabled previously intractable chemical p
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Book Categories

Authors

Second Quantization.

Spin in Second Quantization.

Orbital Rotations.

Exact and Approximate Wave Functions.

The Standard Models.

Atomic Basis Functions.

Short-Range Interactions and Orbital Expansions.

Gaussian Basis Sets.

Molecular Integral Evaluation.

Hartree-Fock Theory.

Configuration-Interaction Theory.

Multiconfigurational Self-Consistent Field Theory.

Coupled-Cluster Theory.

Perturbation Theory.

Calibration of the Electronic-Structure Models.

List of Acronyms.

Index.


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Molecular Electronic-Structure Theory, Ab initio quantum chemistry has emerged as an important tool in chemical research and is appliced to a wide variety of problems in chemistry and molecular physics. Recent developments of computational methods have enabled previously intractable chemical p, Molecular Electronic-Structure Theory

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Molecular Electronic-Structure Theory, Ab initio quantum chemistry has emerged as an important tool in chemical research and is appliced to a wide variety of problems in chemistry and molecular physics. Recent developments of computational methods have enabled previously intractable chemical p, Molecular Electronic-Structure Theory

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Molecular Electronic-Structure Theory, Ab initio quantum chemistry has emerged as an important tool in chemical research and is appliced to a wide variety of problems in chemistry and molecular physics. Recent developments of computational methods have enabled previously intractable chemical p, Molecular Electronic-Structure Theory

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