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Showing 1 - 9 of 9 matches in All Departments
Novel Electronic Structure Theory: General Innovations and Strongly Correlated Systems, Volume 76, the latest release in the Advances in Quantum Chemistry series presents work and reviews of current work in quantum chemistry (molecules), but also includes scattering from atoms and solid state work of interest in physics. Topics covered in this release include the Present Status of Selected Configuration Interaction with Truncation Energy Error, Recent Developments in Asymptotic Expansions from Numerical Analysis and Approximation Theory, The kinetic energy Pauli enhancement factor and its role in determining the shell structure of atoms and molecules, Numerical Hartree-Fock and Many-Body Calculations for Diatomic Molecules, and more.
Advances in Quantum Chemistry, Volume 88 presents the latest ongoing research at the forefront of Electronic structure theory. Chapters in the updated release include Spin-constrained Hartree-Fock and the generator coordinate method for the 2-site Hubbard model, Analytical evaluation of Hylleraas-CI Coulomb and Hybrid two-center Integrals over Slater orbitals, Hartree-Fock-Roothaan Theory of Molecular Compton Profiles Via Position Space Method, Analysis of Research Trend on the Molecular Integrals Over Slater Type Orbitals, An efficient approximation for accelerating convergence of numerical power series, Results for the 1D-Schroedinger equation, The aims and objectives of algebraic molecular orbital theory, and much more.
Electron Correlation in Molecules - ab initio Beyond Gaussian Quantum Chemistry presents a series of articles concerning important topics in quantum chemistry, including surveys of current topics in this rapidly-developing field that has emerged at the cross section of the historically established areas of mathematics, physics, chemistry, and biology.
"Advances in Quantum Chemistry" presents surveys of current topics
in this rapidly developing field that has emerged at the cross
section of the historically established areas of mathematics,
physics, chemistry, and biology. It features detailed reviews
written by leading international researchers. This volume focuses
on thetheory of heavy ion physics in medicine.
"Advances in Quantum Chemistry" presents surveys of current topics
in this rapidly developing field that has emerged at the cross
section of the historically established areas of mathematics,
physics, chemistry, and biology. It features detailed reviews
written by leading international researchers. This volume focuses
on thetheory of heavy ion physics in medicine.
"Advances in the Theory of Quantum Systems in Chemistry and
Physics" is a collection of 32 selected papers from the scientific
contributions presented at the 15th International Workshop on
Quantum Systems in Chemistry and Physics (QSCP-XV), held at
Magdalene College, Cambridge, UK, from August 31st to September
5th, 2010.
Advances in Quantum Chemistry presents surveys of current topics in this rapidly developing field one that has emerged at the cross section of the historically established areas of mathematics, physics, chemistry, and biology. It features detailed reviews written by leading international researchers. In this volume the readers are presented with an exciting combination of themes.
State of the Art of Molecular Electronic Structure Computations: Correlation Methods, Basis Sets and More, Volume 79 in the Advances in Quantum Chemistry series, presents surveys of current topics in this rapidly developing field that has emerged at the cross section of the historically established areas of mathematics, physics, chemistry and biology. Chapters in this new release include Computing accurate molecular properties in real space using multiresolution analysis, Self-consistent electron-nucleus cusp correction for molecular orbitals, Correlated methods for computational spectroscopy, Potential energy curves for the NaH molecule and its cation with the cock space coupled cluster method, and much more.
"Advances in the Theory of Quantum Systems in Chemistry and
Physics" is a collection of 32 selected papers from the scientific
contributions presented at the 15th International Workshop on
Quantum Systems in Chemistry and Physics (QSCP-XV), held at
Magdalene College, Cambridge, UK, from August 31st to September
5th, 2010.
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