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1.

図書
図書
1. Recent progress in quantum Monte Carlo
Shigenori Tanaka, Pierre-Nicholas Roy, Lubos Mitas, editor[s] ; sponsored by the ACS Division of Physical Chemistry
出版情報: Washington, DC : American Chemical Society , [Oxford] : Distributed in print by Oxford University Press, c2016  ix, 173 p. ; 24 cm
シリーズ名: ACS symposium series ; 1234
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2.

図書
図書
2. Structural chemistry : principles, methods, and case studies
Mihai V. Putz, Fanica Cimpoesu, Marilena Ferbinteanu
出版情報: Cham : Springer, c2018  xxx, 802 p. ; 25 cm
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3.

図書
図書
3. New electron correlation methods and their applications, and use of atomic orbitals with exponential asymptotes (hbk.)
edited by Monika Musial, Philip E. Hoggan
出版情報: Cambridge : Elsevier, Academic Press, 2021  xvii, 334 p. ; 24 cm
シリーズ名: Advances in quantum chemistry / edited by Per-Olov Löwdin ; v. 83
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4.

図書
図書
4. Foundations of quantum dynamics
S. M. Blinder
出版情報: London ; New York : Academic Press, 1974  ix, 226 p. ; 24 cm
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5.

図書
図書
5. The chemical bond : a brief introduction to modern structural chemistry
by Linus Pauling
出版情報: Ithaca, N.Y. : Cornell University Press, c1967  xi, 267 p. ; 22 cm
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6.

図書
図書
6. Molecular quantum mechanics. 2nd ed (: pbk)
P.W. Atkins
出版情報: Oxford [Oxfordshire] ; Tokyo : Oxford University Press, 1983  xiii, 471 p. ; 26 cm
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目次情報: 続きを見る
Introduction And Orientation
The Foundations Of Quantum Mechanics / 1：
Operators in quantum mechanics
The postulates of quantum mechanics
The specification of evolution of states
Matrices in quantum mechanics
The plausibility of the schrodinger equation
Exercises
Linear Motion And The Harmonic Oscillator / 2：
The characteristics of acceptable wave functions
Some general remarks on the schrodinger equation
Translational motion
Penetration into and through barriers
Place in a box
The harmonic oscillator
Translation revisted: the scattering matrix
Rotational Motion And The Hydrogen Atom / 3：
Particle on a ring
Particle on a sphere
Particle in a coulombic field
Angular Momentum / 4：
The angular momentum operators
The definition of the states
The angular momenta of composite systems
Problems
Group Theory / 5：
The Symmetries of objects
The calculus of symmetry
Reduced representations
The symmetry properties of functions
The full rotation group
Applications
Techniques Of Approximation / 6：
Time-independent perturbation theory
Variation theory
The Hellmann-Feynman theorem
Time-dependent perturbation theory
Atomic Spectra And Atomic Structure / 7：
The spectrum of atomic hydrogen
The structure of helium
Many-electron atoms
Atoms in external fields
An Introduction To Molecular Structure / 8：
The born-oppenheimer approximation
Molecular orbital theory
Molecular orbital theory of polyatomic molecules
The band theory of solids
The Calculations Of Electronic Structure / 9：
The Hartree-Fock Self-consistent field method
Electron correlation
Density Functional Theory
Gradient Methods and Molecular Properties
Semiempirical methods
Molecular mechanics
Software packages for electronic structure calculations
Molecular Rotations And Vibrations / 10：
Spectroscopic transitions
Molecular rotation
The vibrations of diatomic molecules
The vibrations of polyatomic molecules
Appendix: Centrifugal distortion
Molecular Electronic Transitions / 11：
The states of diatomic molecules
Vibronic transitions
The electronic spectra of polyatomic molecules
The fates of excited species
The Electric Properties Of Molecules / 12：
The response to electric fields
Bulk electrical properties
Optical activity
The Magnetic Properties Of Molecules / 13：
The descriptions of magnetic fields
Magnetic Perturbations
Magnetic Resonance Parameters
Scattering Theory / 14：
The formulation of scattering events
Partical-wave stationary scattering states
Multichannel scattering
Introduction And Orientation
The Foundations Of Quantum Mechanics / 1：
Operators in quantum mechanics
7.

図書
図書
7. The quantum theory of unimolecular reactions
H.O. Pritchard
出版情報: Cambridge ; New York : Cambridge University Press, 1984  xv, 175 p. ; 23 cm
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目次情報: 続きを見る
The observed properties of thermal unimolecular reactions / 1：
The master equation for internal relaxation in molecules / 2：
Reaction as a perturbation of the internal relaxtion / 3：
The specific rate function k(E) as an inverse Laplace transform / 4：
Unimolecular fall-off in strong collision systems / 5：
A molecular dynamic approach to specific rate functions / 6：
Building in the randomisation processes / 7：
Weak collision processes / 8：
How well does it all work? / 9：
Appendix.
The observed properties of thermal unimolecular reactions / 1：
The master equation for internal relaxation in molecules / 2：
Reaction as a perturbation of the internal relaxtion / 3：
8.

図書
図書
8. Applied quantum chemistry
Gábor Náray-Szabó, Péter R. Surján, János Ángyán
出版情報: Dordrecht ; Tokyo : D. Reidel , Hingham, MA : Distributors for the U.S.A. and Canada, Kluwer Academic Publishers Group, c1987  xiv, 489 p. ; 25 cm
シリーズ名: Understanding chemical reactivity
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9.

図書
図書
9. Group theoretical techniques in quantum chemistry
C.D.H. Chisholm
出版情報: London ; New York : Academic Press, 1976  x, 271 p. ; 24 cm
シリーズ名: Theoretical chemistry : a series of monographs ; v. 5
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10.

図書
図書
10. Field theoretical methods in chemical physics (est.)
R. Paul
出版情報: Amsterdam ; New York : Elsevier Scientific Pub. Co., 1982  vii, 414 p. ; 25 cm
シリーズ名: Studies in physical and theoretical chemistry ; 19
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