It takes the average reader 4 hours and 22 minutes to read Computational Methods in Quantum Chemistry, Volume 2 by A A Hasanein
Assuming a reading speed of 250 words per minute. Learn more
This book provides a comprehensive account, from first principles, of the methods of numerical quantum mechanics, beginning with formulations and fundamental postulates. The development continues with that of the Hamiltonian and angular momentum operators, and with methods of approximating the solutions of the Schroedinger equation with variational and perturbation methods. Chapter 3 is a description of the Hartree-Fock self-consistent field method, which is developed systematically for atoms. The Born-Oppenheimer approximation is introduced, and the numerical methods presented one by one thereafter in a logically consistent way that should be accessible to undergraduates. These include LCAO, Hartree-Fock-SCF method for molecules, Roothaan LCAO-MO-SCF method, and electron correlation energy. Chapter 4 is devoted to the more sophisticated computational methods in quantum chemistry, with an introduction to topics that include: the zero differential overlap approximation; Huckel MO theory of conjugated molecules; Pariser-Parr-Pople MO method; extended Huckel theory; neglect of differential overlap methods; invariance in space requirements; CNDO; INDO; NDDO; MINDO; MNDO; AM1; MNDO-PM3; SAM1; SINDO1; CNDO/S; PCILO,Xα; and ab initio methods. This is followed by an introduction to Moller-Plesset perturbation theory of many electrons, and coupled perturbed Hartree Fock theory, with a description of the coupled cluster method. Finally Chapter 5 applies these methods to problems of contemporary interest. The book is designed to be a junior/senior level text in computational quantum mechanics, suitable for undergraduates and graduates in chemistry, physics, computer science, and associated disciplines. Contents: Formulations of Quantum MechanicsMethods for Approximating the Solution of the Schroedinger Wave EquationThe Hartree-Fock Self-Consistent Field MethodComputational Methods in Quantum ChemistryQuantum Mechanical Studies of Hydrogen BondingReferences Readership: Graduate students and undergraduates in chemistry, physics and computer science. keywords:Semiempirical MO Methods;CNDO;INDO;MINDO;AM1;PM3;SAM1;Ab Initio Methods;Theories of the H-Bond;MO Calculations of the H-Bond;Perturbation Theories of the H-Bond
Computational Methods in Quantum Chemistry, Volume 2 by A A Hasanein is 256 pages long, and a total of 65,536 words.
This makes it 86% the length of the average book. It also has 80% more words than the average book.
The average oral reading speed is 183 words per minute. This means it takes 5 hours and 58 minutes to read Computational Methods in Quantum Chemistry, Volume 2 aloud.
Computational Methods in Quantum Chemistry, Volume 2 is suitable for students ages 12 and up.
Note that there may be other factors that effect this rating besides length that are not factored in on this page. This may include things like complex language or sensitive topics not suitable for students of certain ages.
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