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  Partner: UNT College of Arts and Sciences
 Decade: 2010-2019
Biocultural conservation in Cape Horn: the Magellanic woodpecker as a charismatic species

Biocultural conservation in Cape Horn: the Magellanic woodpecker as a charismatic species

Date: March 11, 2010
Creator: Arango, Ximena; Rozzi, Ricardo, 1960-; Massardo, Francisca & Ibarra, J. Tomás
Description: This book chapter discusses a research project to promote biocultural conservation in Cape Horn, Chile. At the southernmost tip of the Americas, the Cape Horn Biosphere Reserve (CHBR) encompasses one of the world's most pristine remaining wilderness areas and is home to the indigenous Yaghan (or Yamana) community, which featured prominently in Charles Darwin's 'Voyage of the Beagle'. Its remoteness and uniqueness, however, are threatened by the introduction of exotic species such as the North American beaver and American mink, increasing development pressures from new connectivity, resource exploitation, and the development of tourism. To implement the biosphere reserve and conserve its natural and cultural richness requires the active participation of the community, as well as linkages and integration between various disciplines and institutions. In an effort to achieve the goal of transdisciplinary integration, the authors used the strategy of identifying a charismatic species, since doing so serves to motivate people towards biodiversity conservation, to communicate ecological concepts, and to integrate both the ecological and social dimensions of sustainability. This study was developed together with the population of Puerto Williams, a town with 2200 inhabitants located on Navarino Island, and the largest human settlement within the CHBR.
Contributing Partner: UNT College of Arts and Sciences
Modified embedded atom method study of the mechanical properties of carbon nanotube reinforced nickel composites

Modified embedded atom method study of the mechanical properties of carbon nanotube reinforced nickel composites

Date: March 11, 2010
Creator: Uddin, Jamal; Baskes, Michael I.; Srinivasan, S.G.; Cundari, Thomas R., 1964- & Wilson, Angela K.
Description: In this article, the authors report an atomistic simulation study of the behavior of nanocomposite materials that are formed by incorporating single-walled carbon nanotubes (SWCNTs), with three different diameters, and a multiwalled carbon nanotube (MWCNT) into a single-crystal nickel matrix. The interactions between carbon and nickel atoms are described by a modified embedded atom method potential. Mechanical properties of these nanocomposite materials are predicted by atomistic calculations and compared with that of fcc nickel and pristine CNTs. The authors' simulations predict that all Ni/CNT composites studied in this work are mechanically stable. Their elastic properties depend on the volume fraction and diameter of embedded CNTs. The single-crystal Young's modulus (E₁₁) of Ni/SWCNT composites exhibit a large increase in the direction of CNTs alignment compared to that of a single-crystal nickel. However, a moderate but gradual decrease is seen for E₂₂ and E₃₃ in the transverse directions with increase in CNT diameters. As a consequence, Ni/SWCNTs show a gradual decrease for the polycrystalline Young's, bulk and shear moduli with the increasing CNT diameters and volume fractions. These reductions, although moderate, suggest that enhancement of mechanical properties for polycrystalline Ni/SWCNT nanocomposites are not achievable at any CNT volume fraction. The Ni/MWCNT composite ...
Contributing Partner: UNT College of Arts and Sciences
Net Hydrogenation of Pt-NHPh Bond Is Catalyzed by Elemental Pt

Net Hydrogenation of Pt-NHPh Bond Is Catalyzed by Elemental Pt

Date: March 11, 2010
Creator: Webb, Joanna R.; Pierpont, Aaron W.; Munro-Leighton, Colleen; Gunnoe, T. Brent; Cundari, Thomas R., 1964- & Boyle, Paul D.
Description: This article discusses the net hydrogenation of Pt-NHPh bond catalyzed by elemental Pt. The addition of H₂ across M-NHR or M-OR moieties is a central reaction for several synthetic transformations. For example, Stryker's reagent, [(Ph₃P)CuH]₆, a catalyst for conjugate addition reactions, is generated by hydrogenolysis of a Cu-OᵗBu bond. Additionally, net H₂ addition across M-O₂CH bonds completes catalytic conversion of CO₂ and H₂ to formic acid, H₂ addition across Pt-OH bonds has been proposed in a cycle for olefin epoxidation, and H₂ addition across M-NHR bonds has been implicated in asymmetric hydrogenations. Despite their importance, reports of well-defined reactions with late(r) transition metal systems are rare and mechanistic studies are limited. Recently, C-H activation of hydrocarbons via net 1,2-addition of C-H bonds across metal-heteroatom bonds using late transition metals (with ≥ 6 d-electrons) bearing formally anionic ligands (e.g., -NHR or -OR) has been reported. Despite interest in these C-H and H-H bond transformations, questions regarding the mechanism remain.
Contributing Partner: UNT College of Arts and Sciences
Coherent excitation of a two-level atom driven by a far-off-resonant classical field: Analytical solutions

Coherent excitation of a two-level atom driven by a far-off-resonant classical field: Analytical solutions

Date: March 15, 2010
Creator: Jha, Pankaj K. & Rostovtsev, Yuri V.
Description: This article discusses the coherent excitation of a two-level atom driven by a far-off-resonant classical field. Abstract: We present an analytical treatment of coherent excitation of a two-level atom driven by a far-off-resonant classical field. A class of pulse envelope is obtained for which this problem is exactly solvable. The solutions are given in terms of the Heun function, which is a generalization of the hypergeometric function. Degeneracy of the Heun to a hypergeometric equation can give all the exactly solvable pulse shapes of Gauss hypergeometric form from the generalized pulse shape obtained here. We discuss the application of the results obtained to the generation of soft x-ray and ultraviolet radiations.
Contributing Partner: UNT College of Arts and Sciences
Probability flux as a method for detecting scaling

Probability flux as a method for detecting scaling

Date: April 5, 2010
Creator: Ignaccolo, Massimiliano; Grigolini, Paolo & West, Bruce J.
Description: In this article, the authors introduce a new method for detecting scaling in time series. The method uses the properties of the probability flux for stochastic self-affine processes and is called the 'probability flux analysis' (PFA). The advantages of this method are: 1) it is independent of the finiteness of the moments of the self-affine process; 2) it does not require a binning procedure for numerical evaluation of the probability density function. These properties make the method particularly efficient for heavy tailed distributions in which the variance is not finite, for example, in Lévy α-stable processes. This utility is established using a comparison with the 'diffusion entropy' (DE) method.
Contributing Partner: UNT College of Arts and Sciences
[Review] Computational Inorganic and Bioinorganic Chemistry

[Review] Computational Inorganic and Bioinorganic Chemistry

Date: April 28, 2010
Creator: Cundari, Thomas R., 1964-
Description: This book review discusses 'Computational Inorganic and Bioinorganic Chemistry', edited by Edward I. Solomon from Stanford University, Robert A. Scott from the University of Georgia Athens, and R. Bruce King from the University of Georgia Athens.
Contributing Partner: UNT College of Arts and Sciences
Femtosecond wave-packet dynamics in cesium dimers studied through controlled stimulated emission

Femtosecond wave-packet dynamics in cesium dimers studied through controlled stimulated emission

Date: May 12, 2010
Creator: Yuan, Luqi; Ariunbold, Gombojav O.; Murawski, Robert K.; Pestov, Dmitry; Wang, Xi; Patnaik, Anil K. et al
Description: This article discusses femtosecond wave-packet dynamics in cesium dimers studied through controlled stimulated emission. Abstract: We study the dynamics of wave packets in cesium dimers using a femtosecond-controlled pump-probe technique. We implement configurations with one pulse (pump) or two pulses (pump to control) to produce vibrational wave packets on the electronic excited state. The transmission of an additional, variable-delay probe pulse is measured to monitor the time evolution of the wave packets. In the case of the pump-control-probe configuration, a superposition of two independent wave packets is observed. In order to elucidate the observed experimental data, we develop a theory based on the Liouville equation for the density matrix associated with the Franck-Condon factors. Both the numerical and analytical calculations are in good agreement with our experimental results.
Contributing Partner: UNT College of Arts and Sciences
Templated Growth of Hexagonal Nickel Carbide Nanocrystals on Vertically Aligned Carbon Nanotubes

Templated Growth of Hexagonal Nickel Carbide Nanocrystals on Vertically Aligned Carbon Nanotubes

Date: May 18, 2010
Creator: Hwang, Jun Y.; Singh, Antariksh; Chaudhari, Mrunalkumar; Tiley, Jaimie; Zhu, Yuntian; Du, Jincheng et al
Description: This article discusses hexagonal nickel carbide. Nanocrystals of hexagonal nickel carbide have been synthesized via physical vapor deposition of elemental nickel onto the surface of vertically aligned carbon nanotubes. Combining high-resolution transmission electron microscopy (HRTEM) with three-dimensional atom probe tomography (3DAP) confirmed that these nanocrystals have a hexagonal structure, are enriched in carbon, and have a composition of ~Ni-25 at. % C (Ni3C). This metastable hexagonal nickel carbide phase appears to be stabilized due to the growth of the nanocrystals on the surface of the nanotubes that act as a template and also as a source of carbon. The stability of this nickel carbide phase has also been investigated by density functional theory (DFT) calculations and compared to the experimental results.
Contributing Partner: UNT College of Arts and Sciences
Calculations Predict That Carbon Tunneling Allows the Degenerate Cope Rearrangement of Semibullvalene to Occur Rapidly at Cryogenic Temperatures

Calculations Predict That Carbon Tunneling Allows the Degenerate Cope Rearrangement of Semibullvalene to Occur Rapidly at Cryogenic Temperatures

Date: May 27, 2010
Creator: Zhang, Xue; Hrovat, David A. & Borden, Weston T., 1943-
Description: This article discusses carbon tunneling. Abstract: Calculations on the role of tunneling in the degenerate Cope rearrangements of semibullvalene (1) and barbaralane (3) predict that, at temperatures below 40 K, tunneling from the lowest vibrational level should make the temperature-independent rate constants k = 1.43 x 10(-3) s(-1) and k = 7.28 x 10(-9) s(-1), respectively. An experiment, using semibullvalene-2(4)-d1, is proposed to test the prediction of rapid tunneling by 1 at cryogenic temperatures.
Contributing Partner: UNT College of Arts and Sciences
Ultradispersive adaptive prism based on a coherently prepared atomic medium

Ultradispersive adaptive prism based on a coherently prepared atomic medium

Date: June 23, 2010
Creator: Sautenkov, Vladimir A.; Li, Hebin; Rostovtsev, Yuri V. & Scully, Marlan O.
Description: In this article, the authors have experimentally demonstrated an ultra-dispersive optical prism made from a coherently driven Rb atomic vapor. The prism possesses spectral angular dispersion that is 6 orders of magnitude higher than that of a prism made of optical glass; such angular dispersion allows one to spatially resolve light beams with different frequencies separated by a few kilohertz. The prism operates near the resonant frequency of atomic vapor and its dispersion is optically controlled by a coherent driving field.
Contributing Partner: UNT College of Arts and Sciences