346 research outputs found

    The future of nuclear power in the developing countries

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    A comprehensive mental health care system for Native Americans in New Mexico. A report of the Native American Mental Health Planning Project.

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    This is a comprehensive report of a seven-month study contracted through the State Division of Mental Health to the University of New Mexico, Department of Psychiatry/Center on Alcoholism, Substance Abuse and Addictions (CASAA). A select committee of representatives from New Mexico tribes, appropriate state and federal agencies, private entities, and consumers provided input for the project. The final plan is based on the collection and triangulation of a variety of sources. The primary sources utilized in this document included: 1) literature review; 2) indirect measure of the magnitude of alcohol, drug abuse, and mental health needs using selected measures from current census data; 3) extensive survey of current agencies providing services; 4) clinical programming survey to select from optional mental health care delivery system models and a prioritization of services needed; 5) ideas, visions, suggestions and recommendations of selected committees; and 6) private interviews and focus group discussions with tribal members, service workers, and tribal leaders. The plan provides information on: 1) epidemiology of mental health problems; 2) programmatic issues for mental health services; 3) needs assessment studies and findings; 4) system and program design; 5) program development and management; 6) physical plant requirements; 7) management information system; and 8) ten-year implementation process. Based on the findings of this planning effort, a system of comprehensive mental health care for American Indians was proposed. This continuum of care extends from the tribal communities, to regional centers of care, and to a centralized facility

    Analyzing and enhancing OSKI for sparse matrix-vector multiplication

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    Sparse matrix-vector multiplication (SpMxV) is a kernel operation widely used in iterative linear solvers. The same sparse matrix is multiplied by a dense vector repeatedly in these solvers. Matrices with irregular sparsity patterns make it difficult to utilize cache locality effectively in SpMxV computations. In this work, we investigate single- and multiple-SpMxV frameworks for exploiting cache locality in SpMxV computations. For the single-SpMxV framework, we propose two cache-size-aware top-down row/column-reordering methods based on 1D and 2D sparse matrix partitioning by utilizing the column-net and enhancing the row-column-net hypergraph models of sparse matrices. The multiple-SpMxV framework depends on splitting a given matrix into a sum of multiple nonzero-disjoint matrices so that the SpMxV operation is performed as a sequence of multiple input- and output-dependent SpMxV operations. For an effective matrix splitting required in this framework, we propose a cache-size-aware top-down approach based on 2D sparse matrix partitioning by utilizing the row-column-net hypergraph model. The primary objective in all of the three methods is to maximize the exploitation of temporal locality. We evaluate the validity of our models and methods on a wide range of sparse matrices by performing actual runs through using OSKI. Experimental results show that proposed methods and models outperform state-of-the-art schemes.Comment: arXiv admin note: substantial text overlap with arXiv:1202.385

    Correlation effects in ionic crystals: I. The cohesive energy of MgO

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    High-level quantum-chemical calculations, using the coupled-cluster approach and extended one-particle basis sets, have been performed for (Mg2+)n (O2-)m clusters embedded in a Madelung potential. The results of these calculations are used for setting up an incremental expansion for the correlation energy of bulk MgO. This way, 96% of the experimental cohesive energy of the MgO crystal is recovered. It is shown that only 60% of the correlation contribution to the cohesive energy is of intra-ionic origin, the remaining part being caused by van der Waals-like inter-ionic excitations.Comment: LaTeX, 20 pages, no figure

    Electron affinities of the first- and second- row atoms: benchmark ab initio and density functional calculations

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    A benchmark ab initio and density functional (DFT) study has been carried out on the electron affinities of the first- and second-row atoms. The ab initio study involves basis sets of spdfghspdfgh and spdfghispdfghi quality, extrapolations to the 1-particle basis set limit, and a combination of the CCSD(T), CCSDT, and full CI electron correlation methods. Scalar relativistic and spin-orbit coupling effects were taken into account. On average, the best ab initio results agree to better than 0.001 eV with the most recent experimental results. Correcting for imperfections in the CCSD(T) method improves the mean absolute error by an order of magnitude, while for accurate results on the second-row atoms inclusion of relativistic corrections is essential. The latter are significantly overestimated at the SCF level; for accurate spin-orbit splitting constants of second-row atoms inclusion of (2s,2p) correlation is essential. In the DFT calculations it is found that results for the 1st-row atoms are very sensitive to the exchange functional, while those for second-row atoms are rather more sensitive to the correlation functional. While the LYP correlation functional works best for first-row atoms, its PW91 counterpart appears to be preferable for second-row atoms. Among ``pure DFT'' (nonhybrid) functionals, G96PW91 (Gill 1996 exchange combined with Perdew-Wang 1991 correlation) puts in the best overall performance. The best results overall are obtained with the 1-parameter hybrid modified Perdew-Wang (mPW1) exchange functionals of Adamo and Barone [J. Chem. Phys. {\bf 108}, 664 (1998)], with mPW1LYP yielding the best results for first-row, and mPW1PW91 for second-row atoms. Indications exist that a hybrid of the type aa mPW1LYP + (1−a)(1-a) mPW1PW91 yields better results than either of the constituent functionals.Comment: Phys. Rev. A, in press (revised version, review of issues concerning DFT and electron affinities added
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