34,284 research outputs found
Understanding thio-effects in simple phosphoryl systems : role of solvent effects and nucleophile charge.
Recent experimental work (J. Org. Chem., 2012, 77, 5829) demonstrated pronounced differences in measured thio-effects for the hydrolysis of (thio)phosphodichloridates by water and hydroxide nucleophiles. In the present work, we have performed detailed quantum chemical calculations of these reactions, with the aim of rationalizing the molecular bases for this discrimination. The calculations highlight the interplay between nucleophile charge and transition state solvation in SN2(P) mechanisms as the basis of these differences, rather than a change in mechanism
Experimental evidence of laser power oscillations induced by the relative Fresnel (Goos-Haenchen) phase
The amplification of the relative Fresnel (Goos-Haenchen) phase by an
appropriate number of total internal reflections and the choice of favorable
incidence angles allow to observe full oscillations in the power of a DPSS
laser transmitted through sequential BK7 blocks. The experimental results
confirm the theoretical predictions. The optical apparatus used in this letter
can be seen as a new type of two-phase ellipsometric system where the phase of
the complex refractive index is replaced by the relative Fresnel
(Goos-Haenchen) phase.Comment: 7 pages, 3 figures, 1 tabl
BRS Cohomology of Zero Curvature Systems II. The Noncomplete Ladder Case
The Yang-Mills type theories and their BRS cohomology are analysed within the
zero curvature formalism.Comment: 14 pages, latex, no figures, latex improve
Ground-state configurations in ferromagnetic nanotori
Magnetization ground states are studied in toroidal nanomagnets. The
energetics associated to the ferromagnetic, vortex and onion-like
configurations are explicitly computed. The analysis reveals that the vortex
appears to be the most prominent of such states, minimizing total energy in
every torus with internal radius (for Permalloy). For
the vortex remains the most favorable pattern whenever
( is the torus external radius and is
the exchange length), being substituted by the ferromagnetic state whenever
.Comment: 16 pages, 9 figures, 3 apendices, Revtex forma
Probing the two-scale-factor universality hypothesis by exact rotation symmetry-breaking mechanism
We probe the two-scale factor universality hypothesis by evaluating, firstly
explicitly and analytically at the one-loop order, the loop quantum corrections
to the amplitude ratios for O() scalar field theories with
rotation symmetry-breaking in three distinct and independent methods in which
the rotation symmetry-breaking mechanism is treated exactly. We show that the
rotation symmetry-breaking amplitude ratios turn out to be identical in the
three methods and equal to their respective rotation symmetry-breaking ones,
although the amplitudes themselves, in general, depend on the method employed
and on the rotation symmetry-breaking parameter. At the end, we show that all
these results can be generalized, through an inductive process based on a
general theorem emerging from the exact calculation, to any loop level and
physically interpreted based on symmetry ideas.Comment: 17 pages, 3 figure
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