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28 matches in All Departments
T. Ziegler: A Chronicle About the Development of Electronic
Structure Theories for Transition Metal Complexes.- J. Linderberg:
Orbital Models and Electronic Structure Theory.- J.S. and J.E.
Avery: Sturmians and Generalized Sturmians in Quantum Theory.- B.T
Sutcliffe: Chemistry as a "Manifestation of Quantum Phenomena" and
the Born-Oppenheimer Approximation?- A.J. McCaffery: From Ligand
Field Theory to Molecular Collision Dynamics: A Common Thread of
Angular Momentum.- M. Atanasov, D. Ganyushin, K. Sivalingam and F.
Neese: A Modern First-Principles View on Ligand Field Theory
Through the Eyes of Correlated Multireference Wavefunctions.- R.S.
Berry and B.M. Smirnov: The Phase Rule: Beyond Myopia to
Understanding.
S.C. Singhal and X.-D. Zhou: Solid Oxide Fuel Cells.- H. Wang
and H.D. Abruna/: Electrocatalysis of Direct Alcohol Fuel Cells:
Quantitative DEMS Studies.- J. Benziger, A. Bocarsly, M.J. Cheah,
P.Majsztrik, B. Satterfield and Q. Zhao: Mechanical and Transport
Properties of Nafion: Effects of Temperature and Water Activity.-
S. Sachdeva, J. A. Turner, J.L. Horana and A. M. Herring: The Use
of Heteropoly Acids in Proton Exchange Fuel Cells.- M. T. Kelly:
Perspective on the Storage of Hydrogen: Past and Future.-"
J.P. Dahl: Carl Johan Ballhausen (1926-2010).- J.R. Winkler and
H.B. Gray: Electronic Structures of Oxo-Metal Ions.- C.D. Flint:
Early Days in Kemisk Laboratorium IV and Later Studies.- J.H.
Palmer: Transition Metal Corrole Coordination Chemistry. A Review
Focusing on Electronic Structural Studies.- W.C. Trogler: Chemical
Sensing with Semiconducting Metal Phthalocyanines.- K.M. Lancaster:
Biological Outer-Sphere Coordination.- R.K. Hocking and E.I.
Solomon: Ligand Field and Molecular Orbital Theories of Transition
Metal X-ray Absorption Edge Transitions.- K.B. Moller and N.E.
Henriksen: Time-resolved X-ray diffraction: The dynamics of the
chemical bond.
Using the spin-Hamiltonian formalism the magnetic parameters are
introduced through the components of the Lambda-tensor involving
only the matrix elements of the angular momentum operator. The
energy levels for a variety of spins are generated and the modeling
of the magnetization, the magnetic susceptibility and the heat
capacity is done. Theoretical formulae necessary in performing the
energy level calculations for a multi-term system are prepared with
the help of the irreducible tensor operator approach. The goal of
the programming lies in the fact that the entire relevant matrix
elements (electron repulsion, crystal field, spin-orbit
interaction, orbital-Zeeman, and spin-Zeeman operators) are
evaluated in the basis set of free-atom terms. The modeling of the
zero-field splitting is done at three levels of sophistication. The
spin-Hamiltonian formalism offers simple formulae for the magnetic
parameters by evaluating the matrix elements of the angular
momentum operator in the basis set of the crystal-field terms. The
magnetic functions for dn complexes are modeled for a wide range of
the crystal-field strengths.
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Biochemistry (Hardcover, 1975 ed.)
Xue Duan, Lutz H. Gade, Gerard Parkin, Kenneth R. Poeppelmeier, Fraser Andrew Armstrong, …
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R2,856
Discovery Miles 28 560
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Ships in 10 - 15 working days
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J.P. Dahl: Carl Johan Ballhausen (1926-2010).- J.R. Winkler and
H.B. Gray: Electronic Structures of Oxo-Metal Ions.- C.D. Flint:
Early Days in Kemisk Laboratorium IV and Later Studies.- J.H.
Palmer: Transition Metal Corrole Coordination Chemistry. A Review
Focusing on Electronic Structural Studies.- W.C. Trogler: Chemical
Sensing with Semiconducting Metal Phthalocyanines.- K.M. Lancaster:
Biological Outer-Sphere Coordination.- R.K. Hocking and E.I.
Solomon: Ligand Field and Molecular Orbital Theories of Transition
Metal X-ray Absorption Edge Transitions.- K.B. Moller and N.E.
Henriksen: Time-resolved X-ray diffraction: The dynamics of the
chemical bond.
T. Ziegler: A Chronicle About the Development of Electronic
Structure Theories for Transition Metal Complexes.- J. Linderberg:
Orbital Models and Electronic Structure Theory.- J.S. and J.E.
Avery: Sturmians and Generalized Sturmians in Quantum Theory.- B.T
Sutcliffe: Chemistry as a "Manifestation of Quantum Phenomena" and
the Born-Oppenheimer Approximation?- A.J. McCaffery: From Ligand
Field Theory to Molecular Collision Dynamics: A Common Thread of
Angular Momentum.- M. Atanasov, D. Ganyushin, K. Sivalingam and F.
Neese: A Modern First-Principles View on Ligand Field Theory
Through the Eyes of Correlated Multireference Wavefunctions.- R.S.
Berry and B.M. Smirnov: The Phase Rule: Beyond Myopia to
Understanding.
S.C. Singhal and X.-D. Zhou: Solid Oxide Fuel Cells.- H. Wang
and H.D. Abruna/: Electrocatalysis of Direct Alcohol Fuel Cells:
Quantitative DEMS Studies.- J. Benziger, A. Bocarsly, M.J. Cheah,
P.Majsztrik, B. Satterfield and Q. Zhao: Mechanical and Transport
Properties of Nafion: Effects of Temperature and Water Activity.-
S. Sachdeva, J. A. Turner, J.L. Horana and A. M. Herring: The Use
of Heteropoly Acids in Proton Exchange Fuel Cells.- M. T. Kelly:
Perspective on the Storage of Hydrogen: Past and Future.-"
Using the spin-Hamiltonian formalism the magnetic parameters are
introduced through the components of the Lambda-tensor involving
only the matrix elements of the angular momentum operator. The
energy levels for a variety of spins are generated and the modeling
of the magnetization, the magnetic susceptibility and the heat
capacity is done. Theoretical formulae necessary in performing the
energy level calculations for a multi-term system are prepared with
the help of the irreducible tensor operator approach. The goal of
the programming lies in the fact that the entire relevant matrix
elements (electron repulsion, crystal field, spin-orbit
interaction, orbital-Zeeman, and spin-Zeeman operators) are
evaluated in the basis set of free-atom terms. The modeling of the
zero-field splitting is done at three levels of sophistication. The
spin-Hamiltonian formalism offers simple formulae for the magnetic
parameters by evaluating the matrix elements of the angular
momentum operator in the basis set of the crystal-field terms. The
magnetic functions for dn complexes are modeled for a wide range of
the crystal-field strengths.
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