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1.
Christiane Quesne 《Czechoslovak Journal of Physics》1996,46(2-3):249-254
A few years ago, Matsuo and Cherednik proved that from some solutions of the Knizhnik-Zamolodchikov (KZ) equations, which first appeared in conformal field theory, one can obtain wave functions for the Calogero integrable system. In the present communication, it is shown that from some solutions of generalized KZ equations, one can construct wave functions, characterized by any given permutational symmetry, for some Calogero-Sutherland-Moser integrable models with exchange terms. Such models include the spin generalizations of the original Calogero and Sutherland ones, as well as that with -function interaction.Presented at the 4th Colloquium Quantum Groups and Integrable Systems, Prague, 22–24 June 1995 相似文献
2.
Back Cover: Quantum Mechanics/Molecular Mechanics Study on the Oxygen Binding and Substrate Hydroxylation Step in AlkB Repair Enzymes (Chem. Eur. J. 2/2014)
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3.
Dramatic Influence of an Anionic Donor on the Oxygen‐Atom Transfer Reactivity of a MnV–Oxo Complex
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Heather M. Neu Dr. Matthew G. Quesne Tzuhsiung Yang Dr. Katharine A. Prokop‐Prigge Prof. Kyle M. Lancaster James Donohoe Prof. Serena DeBeer Dr. Sam P. de Visser Prof. David P. Goldberg 《Chemistry (Weinheim an der Bergstrasse, Germany)》2014,20(45):14584-14588
Addition of an anionic donor to an MnV(O) porphyrinoid complex causes a dramatic increase in 2‐electron oxygen‐atom‐transfer (OAT) chemistry. The 6‐coordinate [MnV(O)(TBP8Cz)(CN)]? was generated from addition of Bu4N+CN? to the 5‐coordinate MnV(O) precursor. The cyanide‐ligated complex was characterized for the first time by Mn K‐edge X‐ray absorption spectroscopy (XAS) and gives Mn?O=1.53 Å, Mn?CN=2.21 Å. In combination with computational studies these distances were shown to correlate with a singlet ground state. Reaction of the CN? complex with thioethers results in OAT to give the corresponding sulfoxide and a 2e?‐reduced MnIII(CN)? complex. Kinetic measurements reveal a dramatic rate enhancement for OAT of approximately 24 000‐fold versus the same reaction for the parent 5‐coordinate complex. An Eyring analysis gives ΔH≠=14 kcal mol?1, ΔS≠=?10 cal mol?1 K?1. Computational studies fully support the structures, spin states, and relative reactivity of the 5‐ and 6‐coordinate MnV(O) complexes. 相似文献
4.
C. Quesne 《Czechoslovak Journal of Physics》1998,48(11):1471-1476
GLh(n) × GLh(m)-covariant h-bosonic algebras are built by contracting the GLq(n) × GLq(m)-covariant q-bosonic algebras considered by the present author some years ago. Their defining relations are written in terms of the corresponding R
h-matrices. Whenever n = 2, and m = 1 or 2, it is proved by using Uh(sl(2)) Clebsch-Gordan coefficients that they can also be expressed in terms of coupled commutators in a way entirely similar to the classical case. Some Uh(sl(2)) rank-(1/2) irreducible tensor operators, recently constructed by Aizawa in terms of standard bosonic operators, are shown to provide a realization of the h-bosonic algebra corresponding to n = 2 and m = 1. 相似文献
5.
C. Quesne 《Physics letters. [Part B]》1975,57(5):422-424
Analytic expressions are derived for the partial widths of the fixed generalized seniority spectral distributions, using an expansion of the hamiltonian in terms of irreducible tensors with respect to both symplectic and quasi-spin groups. 相似文献
6.
A method is developed to exactly calculate the fixedJ quasiparticle centroid energies and partial widths. Some results obtained in the even-mass lead isotopes with various interactions are analysed. FixedJ quasiparticle distributions are used to predict an upper limit for the deviations between the quasiparticle approximation and the shell model results for the low-energy levels. The influence of the states with a high quasiparticle number in the low-energy region is seen to strongly depend upon the interaction. The importance of the dimensionalities and the internal widths in explaining the admixtures is stressed. 相似文献
7.
To lowest order of perturbation theory we show that an equivalence can be established between a
-symmetric generalized quartic anharmonic oscillator model and a Hermitian position-dependent mass Hamiltonian h. An important feature of h is that it reveals a domain of couplings where the quartic potential could be attractive, vanishing or repulsive. We also
determine the associated physical quantities. 相似文献
8.
The representation theory of the generalized deformed oscillator algebras (GDOA's) is developed. GDOA's are generated by the four operators {1, a, a
, N}. Their commutators and Hermiticity properties are those of the boson oscillator algebra, except for [a, a
]
q
= G(N), where [a, b]
q
= ab – q ba and G(N) is a Hermitian, analytic function. The unitary irreductible representations are obtained by means of a Casimir operator C and the semi-positive operator a
a. They may belong to one out of four classes: bounded from below (BFB), bounded from above (BFA), finite-dimentional (FD), unbounded (UB). Some examples of these different types of unirreps are given. 相似文献
9.
Gonzalez-Ovalle LE Quesne MG Kumar D Goldberg DP de Visser SP 《Organic & biomolecular chemistry》2012,10(28):5401-5409
Density functional theory (DFT) calculations are presented on biomimetic model complexes of cysteine dioxygenase and focus on the effect of axial and equatorial ligand placement. Recent studies by one of us [Y. M. Badiei, M. A. Siegler and D. P. Goldberg, J. Am. Chem. Soc. 2011, 133, 1274] gave evidence of a nonheme iron biomimetic model of cysteine dioxygenase using an i-propyl-bis(imino)pyridine, equatorial tridentate ligand. Addition of thiophenol, an anion - either chloride or triflate - and molecular oxygen, led to several possible stereoisomers of this cysteine dioxygenase biomimetic complex. Moreover, large differences in reactivity using chloride as compared to triflate as the binding anion were observed. Here we present a series of DFT calculations on the origin of these reactivity differences and show that it is caused by the preference of coordination site of anion versus thiophenol binding to the chemical system. Thus, stereochemical interactions of triflate and the bulky iso-propyl substituents of the ligand prevent binding of thiophenol in the trans position using triflate. By contrast, smaller anions, such as chloride, can bind in either cis or trans ligand positions and give isomers with similar stability. Our calculations help to explain the observance of thiophenol dioxygenation by this biomimetic system and gives details of the reactivity differences of ligated chloride versus triflate. 相似文献
10.
C. Quesne 《International Journal of Theoretical Physics》1999,38(7):1905-1923
GLh(n) ×GLh(m)-covariant (hh)-bosonic[or (hh)-fermionic] algebras
are built in terms of thecorresponding Rh and
-matrices by contracting theGLq(n) ×
-covariant q-bosonic (or q-fermionic) algebras
, = 1, 2.When using a basis of
wherein theannihilation operators are contragredient to thecreation ones, this contraction procedure can be carried out for any n, m values. Whenemploying instead a basis wherein the annihilationoperators, like the creation ones, are irreducibletensor operators with respect to the dual quantumalgebra Uq(gl(n))
, a contraction limit only exists forn, m {1, 2, 4, 6, . . .}. For n = 2, m = 1, andn = m = 2, the resulting relations can be expressed interms of coupled (anti)commutators (as in the classical case), by usingUh(sl(2)) [instead of s1(2)] Clebsch-Gordancoefficients. Some Uh(sl(2)) rank-1/2irreducible tensor operators recently constructed byAizawa are shown to provide a realization of
(2, 1). 相似文献