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Recent Advances in the Theory of Chemical and Physical Systems

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Cover of 'Recent Advances in the Theory of Chemical and Physical Systems'

Table of Contents

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    Book Overview
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    Chapter 1 THEORY AND COMPUTATION IN THE STUDY OF MOLECULAR STRUCTURE
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    Chapter 2 COUPLED-CLUSTERANDCONFIGURATION-INTERACTION APPROACHES TO QUASIDEGENERACY
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    Chapter 3 NONITERATIVE COUPLED-CLUSTER METHODS FOR EXCITED ELECTRONIC STATES
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    Chapter 4 EXCITED STATE SELF-CONSISTENT FIELD THEORY USING EVEN-TEMPERED PRIMITIVE GAUSSIAN BASIS SETS
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    Chapter 5 PRACTICABLE FACTORIZED TDLDA FOR ARBITRARY DENSITY- AND CURRENT-DEPENDENT FUNCTIONALS
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    Chapter 6 INEQUALITIES RELATING THE ELEMENTS OF THE SECOND-ORDER REDUCED DENSITY MATRIX
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    Chapter 7 STRUTINSKY’S SHELL-CORRECTION METHOD IN THE EXTENDED KOHN-SHAM SCHEME: APPLICATIONTOTHE IONIZATION POTENTIAL, ELECTRON AFFINITY, ELECTRONEGATIVITY AND CHEMICAL HARDNESS OF ATOMS
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    Chapter 8 GENERALIZED DIABATIC STUDY OF ETHYLENE “ISOMERISM“
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    Chapter 9 PROGRESS WITH BERTHA: A RELATIVISTIC ATOMIC AND MOLECULAR STRUCTURE PACKAGE
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    Chapter 10 NON-STANDARD REPRESENTATIONS OF THE DIRAC EQUATION AND THE VARIATIONAL METHOD
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    Chapter 11 GENERALIZED RECPACCOUNTING FOR BREIT EFFECTS: URANIUM, PLUTONIUM AND SUPERHEAVY ELEMENTS 112, 113, 114
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    Chapter 12 P,T-PARITYVIOLATIONEFFECTS INPOLARHEAVY-ATOM MOLECULES
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    Chapter 13 QED CALCULATION OF HEAVY MULTICHARGED IONS WITH ACCOUNT FOR CORRELATION, RADIATIVE AND NUCLEAR EFFECTS
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    Chapter 14 QUANTUM CALCULATION OF COOPERATIVE MUON-NUCLEAR PROCESSES: DISCHARGE OF METASTABLE NUCLEI DURING NEGATIVE MUON CAPTURE
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    Chapter 15 COMPUTER SIMULATIONS IN HEAVY PARTICLE COLLISIONS
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    Chapter 16 STUDY OF INTERACTION ABILITIES USING AN ENERGY PARTITIONING SCHEME IN SOME WATER CLUSTERS
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    Chapter 17 ABINITIO VAN DERWAALS POTENTIAL ENERGYSURFACES APPLICATION TO COMPLEXES OF BROMINE MOLECULE WITH HELIUM ATOMS
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    Chapter 18 ONE-ELECTRON PSEUDO-POTENTIAL INVESTIGATION OF Na(3p 2 P)Ar n CLUSTERS: ELECTRONICALLY EXCITED ISOMERS AND EMISSION SPECTRA
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    Chapter 19 UNDERSTANDING CHEMICAL REACTIONS INVOLVING NON-ADIABATIC TRANSITIONS: PREDISSOCIATION OF THE ELECTRONICALLY EXCITED Li-HF COMPLEX
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    Chapter 20 DENSITY FUNCTIONAL STUDIES OF NOBLE METAL CLUSTERS. ADSORPTION OF O 2 AND CO ON GOLD AND SILVER CLUSTERS
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    Chapter 21 THREE-GOLD CLUSTER AS PROTON ACCEPTOR IN NONCONVENTIONAL HYDROGEN BONDS O-H…Au AND N-H…Au
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    Chapter 22 MOLECULAR MODELLING OF METAL COMPLEXES WITH OPEN d -SHELL
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    Chapter 23 AB-INITIO GUTZWILLER METHOD: FIRST APPLICATION TO PLUTONIUM
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    Chapter 24 AB-INITIO QUANTUM DIFFUSION IN QUASICRYSTALS
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    Chapter 25 TOWARDS NANOSTRUCTURED MATERIALS: AN EXAMPLE OF BORON NANOTUBES
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    Chapter 26 STOCHASTICOPTIMIZATION METHODS FOR PROTEIN FOLDING
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Title
Recent Advances in the Theory of Chemical and Physical Systems
Published by
Springer Netherlands, May 2006
DOI 10.1007/1-4020-4528-x
ISBNs
978-1-4020-4527-1, 978-1-4020-4528-8
Editors

JULIEN, JEAN-PIERRE, MARUANI, JEAN, MAYOU, DIDIER, WILSON, STEPHEN, DELGADO-BARRIO, GERARDO

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X Demographics

The data shown below were collected from the profile of 1 X user who shared this research output. Click here to find out more about how the information was compiled.
Mendeley readers

Mendeley readers

The data shown below were compiled from readership statistics for 11 Mendeley readers of this research output. Click here to see the associated Mendeley record.

Geographical breakdown

Country Count As %
China 1 9%
Unknown 10 91%

Demographic breakdown

Readers by professional status Count As %
Researcher 3 27%
Student > Ph. D. Student 3 27%
Student > Master 2 18%
Professor 1 9%
Student > Postgraduate 1 9%
Other 0 0%
Unknown 1 9%
Readers by discipline Count As %
Chemistry 8 73%
Physics and Astronomy 1 9%
Sports and Recreations 1 9%
Unknown 1 9%