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COUPLING-CONSTANTS

13C 1H coupling constants as a conformational tool for structural assignment of quinic and octulosonic Acid

13C 1H coupling constants as a conformational tool for structural assignment of quinic and octulosonic Acid

... the coupling constants was computed with a modified, uncontracted, version of the 6-311G(d,p) basis set, with additional tight polarization ...spin-spin coupling constants was found to be ...

8

Decomposition of nuclear magnetic resonance spin-spin coupling constants into active and passive orbital contributions

Decomposition of nuclear magnetic resonance spin-spin coupling constants into active and passive orbital contributions

... H–H coupling constants agree well for the semi- empirical INDO/SOS2 and the CP–DFT/B3LYP method, even though the values for the total FC terms differ strongly between the two ...

17

Measurement of hyperfine coupling constants of muoniated radicals in small molecule semiconductors

Measurement of hyperfine coupling constants of muoniated radicals in small molecule semiconductors

... hyperfine coupling constants of muoniated radicals formed in a number of organic semiconductors, via transverse field measurements taken in the Paschen Back limit, and compare the results to avoided level ...

7

Molecular properties in the Tamm–Dancoff approximation: indirect nuclear spin–spin coupling constants

Molecular properties in the Tamm–Dancoff approximation: indirect nuclear spin–spin coupling constants

... The connection between the limited accuracy of DFT for spin–spin couplings and the triplet instability that affects the calculation of triplet excitation energies was recently explored by Lutnæs et al. [7]. The triplet ...

20

Correlating Pt P bond lengths and Pt P coupling constants

Correlating Pt P bond lengths and Pt P coupling constants

... complexes with larger values indicating a move towards more ideal sp 3 hybridisation however we did not observe any correlation in this regard.. It thus appears that in a narrow series of complexes the coupling ...

20

Understanding Nuclear Binding Energy with Strong and Electroweak Coupling Constants

Understanding Nuclear Binding Energy with Strong and Electroweak Coupling Constants

... At this juncture, one important question to be answered and reviewed at basic level is: How to understand nuclear interactions in terms of sub nuclear interactions? Unfortunately, 1) At 1.2 fm scale, there is no ...

5

Relativistic density functional for nuclear matter

Relativistic density functional for nuclear matter

... dependent coupling constants for the scalar and vector mesons by an explicit evaluation of Fock expressions and relating them to the Hartree parts through the e ff ective ...

6

Understanding strong coupling constant, nuclear stability and binding energy with three atomic gravitational constants - A short communication

Understanding strong coupling constant, nuclear stability and binding energy with three atomic gravitational constants - A short communication

... In this context, we would like to emphasize the fact that, physics and mathematics associated with fixing of the energy coefficients of SEMF are neither connected with residual strong nuclear force nor connected with ...

5

Clinical Decision Making of Nurses Regarding Elder Abuse

Clinical Decision Making of Nurses Regarding Elder Abuse

... annealing for the calculation of macromolecular structures from the restraints derived from NMR data. The initial inputs to the program consisted of 181 integrated cross-peak volumes (NOESY) and 11 coupling ...

148

ESR studies on some naphthalene derivatives

ESR studies on some naphthalene derivatives

... Least Squares Refinement of the Additivity Parameters 197 for a Protons in Peri-alkylnaphthalene Anion Radicals Coupling Constants for Methylnaphthalene Anion 199 Radicals Least Squares [r] ...

243

I.

I.

... negative coupling constants, for which case, however, the inuence of higher orders in curvature are also suppressed, though at a much smaller rate, so that corrections of even the 10th and higher orders in ...

8

Dynamics of a large extra dimension inspired hybrid inflation model

Dynamics of a large extra dimension inspired hybrid inflation model

... effective coupling of the false vacuum field has to be tiny, ⬃ 10 ⫺ 30 关 17 兴 ...damental coupling constants of order unity and fundamental scale ⬃ 100 TeV 关 14,7 兴兲 , the bare mass of the false ...

9

Quantum Phase Transition in Triple Quantum Dot System and Its Consequences on Transport

Quantum Phase Transition in Triple Quantum Dot System and Its Consequences on Transport

... The coupling between dots and the coupling between dot and lead( which includes the Kondo effect at low enough temperature) can be ...dominant coupling can change the behaviour of the system and one ...

103

2 Iso­butyl 2 phosphabi­cyclo­[3 3 1]nonane 2 selenide

2 Iso­butyl 2 phosphabi­cyclo­[3 3 1]nonane 2 selenide

... Compound (I) crystallizes in the monoclinic space group P2/c and consists of the VCH backbone, the iso-butyl side chain and the selenium atom coordinated to phosphorus in a tetrahedral fashion. The compound contains two ...

8

A novel glycosidic steroidal alkaloid from solanum aculeastrum

A novel glycosidic steroidal alkaloid from solanum aculeastrum

... the coupling constants of the anomeric protons while the α-configuration of rhamnose was ascertained from comparison with similar sugars in literature [12, ...

7

The Relationship between R&D Investment and Dividend Payment Tax Incentives and Their Role in the Dividend Tax Puzzle

The Relationship between R&D Investment and Dividend Payment Tax Incentives and Their Role in the Dividend Tax Puzzle

... Schema 6.6 shows a 9EtG molecule with the system of hydrogen bonds and close contacts in its single crystal environment as revealed by the X-ray diffraction study. 1 In order to understand the formation and stabilization ...

244

The axial charge of the nucleon on the lattice and in chiral perturbation theory

The axial charge of the nucleon on the lattice and in chiral perturbation theory

... In its standard form, ChEFT describes low-energy QCD by means of an effective field theory based on effective pion, nucleon, . . . fields. Since the effective Lagrangian does not depend on the volume, besides the ...

6

The decay J/ψ → γX(JP) → γϕϕ: Dynamical analysis of the X(JP) → ϕϕ resonance contributions

The decay J/ψ → γX(JP) → γϕϕ: Dynamical analysis of the X(JP) → ϕϕ resonance contributions

... effective coupling constants parametrizing invariant am- plitudes are extracted from the fits and used for evaluation of branching fractions B X(J PC )→φφ ...

6

Carbon­yl(cyclo­hexyl­di­phenyl­phosphine)(8 hy­droxy­quinolinato)rhodium(I)

Carbon­yl(cyclo­hexyl­di­phenyl­phosphine)(8 hy­droxy­quinolinato)rhodium(I)

... Bond distances, bite angles and the effective cone angle for (I) are compared with those of similar structures in Table 2. A reasonable correlation between the bond distances and angles for the quinoline rings is ...

9

Ab initio derivation of model energy density functionals

Ab initio derivation of model energy density functionals

... deriving coupling constants of model energy density functionals (EDFs) directly from ab initio calculations performed for finite fermion ...the coupling constants of the quasilocal Skyrme ...

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