Resource Type

THM Model Validation: Integrated Assessment of Measured and Predicted Behavior (open access)

THM Model Validation: Integrated Assessment of Measured and Predicted Behavior

This paper presents results of coupled thermal-hydrological-mechanical (THM) simulations of two field-scale tests that are part of the thermal testing program being conducted by the Yucca Mountain Site Characterization Project. The two tests analyzed are the Drift-Scale Test (DST) which is sited in an alcove of the Exploratory Studies Facility at Yucca Mountain, Nevada, and the Large Block Test (LBT) which is sited at Fran Ridge, near Yucca Mountain, Nevada. Both of these tests were designed to investigate coupled thermal-mechanical-hydrological-chemical (TMHC) behavior in a fractured, densely welded ash-flow tuff. The geomechanical response of the rock mass forming the DST and the LBT is analyzed using a coupled THM model. A coupled model for analysis of the DST and LBT has been formulated by linking the 3DEC distinct element code for thermal-mechanical analysis and the NUFT finite element code for thermal-hydrologic analysis. The TH model (NUFT) computes temperatures at preselected times using a model that extends from the surface to the water table. The temperatures computed by NUFT are input to 3DEC, which then computes stresses and deformations. The distinct element method was chosen to permit the inclusion of discrete fractures and explicit modeling of fracture deformations. Shear deformations and normal …
Date: October 10, 2001
Creator: Blair, S C; Carlson, S R; Wagoner, J; Wagner, R & Vogt, T
System: The UNT Digital Library
Semianalytical solutions of radioactive or reactive transport invariably-fractured layered media: 1. Solutes (open access)

Semianalytical solutions of radioactive or reactive transport invariably-fractured layered media: 1. Solutes

In this paper, semianalytical solutions are developed for the problem of transport of radioactive or reactive solute tracers through a layered system of heterogeneous fractured media with misaligned fractures. The tracer transport equations in the non-flowing matrix account for (a) diffusion, (b) surface diffusion, (c) mass transfer between the mobile and immobile water fractions, (d) linear kinetic or equilibrium physical, chemical, or combined solute sorption or colloid filtration, and (e) radioactive decay or first-order chemical reactions. The tracer-transport equations in the fractures account for the same processes, in addition to advection and hydrodynamic dispersion. Any number of radioactive decay daughter products (or products of a linear, first-order reaction chain) can be tracked. The solutions, which are analytical in the Laplace space, are numerically inverted to provide the solution in time and can accommodate any number of fractured and/or porous layers. The solutions are verified using analytical solutions for limiting cases of solute and colloid transport through fractured and porous media. The effect of important parameters on the transport of {sup 3}H, {sup 237}Np and {sup 239}Pu (and its daughters) is investigated in several test problems involving layered geological systems of varying complexity.
Date: October 10, 2001
Creator: Moridis, George J.
System: The UNT Digital Library
The computational crystallography toolbox: Crystallographic algorithms in a modern software framework (open access)

The computational crystallography toolbox: Crystallographic algorithms in a modern software framework

None
Date: October 10, 2001
Creator: Grosse-Kunstleve, Ralf W.; Sauter, Nicholas K.; Moriarty, Nigel W. & Adams, Paul D.
System: The UNT Digital Library
Laser ablation in analytical chemistry - A review (open access)

Laser ablation in analytical chemistry - A review

Laser ablation is becoming a dominant technology for direct solid sampling in analytical chemistry. Laser ablation refers to the process in which an intense burst of energy delivered by a short laser pulse is used to sample (remove a portion of) a material. The advantages of laser ablation chemical analysis include direct characterization of solids, no chemical procedures for dissolution, reduced risk of contamination or sample loss, analysis of very small samples not separable for solution analysis, and determination of spatial distributions of elemental composition. This review describes recent research to understand and utilize laser ablation for direct solid sampling, with emphasis on sample introduction to an inductively coupled plasma (ICP). Current research related to contemporary experimental systems, calibration and optimization, and fractionation is discussed, with a summary of applications in several areas.
Date: October 10, 2001
Creator: Russo, Richard E.; Mao, Xianglei; Liu, Haichen; Gonzalez, Jhanis & Mao, Samuel S.
System: The UNT Digital Library
ATM phosphorylates histone H2AX in response to DNA double-strand breaks (open access)

ATM phosphorylates histone H2AX in response to DNA double-strand breaks

None
Date: October 10, 2001
Creator: Burma, Sandeep; Chen, Benjamin P.; Murphy, Michael; Kurimasa, Akihiro & Chen, David J.
System: The UNT Digital Library
Consumer life-cycle cost impacts of energy-efficiency standards for residential-type central air conditioners and heat pumps (open access)

Consumer life-cycle cost impacts of energy-efficiency standards for residential-type central air conditioners and heat pumps

In support of the federal government's efforts to raise the minimum energy-efficiency standards for residential-type central air conditioners and heat pumps, a consumer life-cycle cost (LCC) analysis was conducted to demonstrate the economic impacts on individual consumers from revisions to the standards. LCC is the consumer's cost of purchasing and installing an air conditioner or heat pump and operating the unit over its lifetime. The LCC analysis is conducted on a nationally representative sample of air conditioner and heat pump consumers resulting in a distribution of LCC impacts showing the percentage of consumers that are either benefiting or being burdened by increased standards. Relative to the existing minimum efficiency standard of 10 SEER, the results show that a majority of split system air conditioner and heat pump consumers will either benefit or be insignificantly impacted by increased efficiency standards of up to 13 SEER.
Date: October 10, 2001
Creator: Rosenquist, Gregory; Chan, Peter; Lekov, Alex; McMahon, James & Van Buskirk, Robert
System: The UNT Digital Library
Oligomerization of Chromium (III) and its impact on the oxidation of Chromium (III) by Hydrogen Peroxide in alkaline solutions (open access)

Oligomerization of Chromium (III) and its impact on the oxidation of Chromium (III) by Hydrogen Peroxide in alkaline solutions

None
Date: October 10, 2001
Creator: Rao, Linfeng; Zhang, Zhicheng; Friese, Judah I.; Ritherdon, B.; Clark, Sue B.; Hess, Nancy J. et al.
System: The UNT Digital Library
Impact of the implementation of MPI point-to-point communications on the performance of two general sparse solvers (open access)

Impact of the implementation of MPI point-to-point communications on the performance of two general sparse solvers

We examine the mechanics of the send and receive mechanism of MPI and in particular how we can implement message passing in a robust way so that our performance is not significantly affected by changes to the MPI system. This leads us to using the Isend/Irecv protocol which will entail sometimes significant algorithmic changes. We discuss this within the context of two different algorithms for sparse Gaussian elimination that we have parallelized. One is a multifrontal solver called MUMPS, the other is a supernodal solver called SuperLU. Both algorithms are difficult to parallelize on distributed memory machines. Our initial strategies were based on simple MPI point-to-point communication primitives. With such approaches, the parallel performance of both codes are very sensitive to the MPI implementation, the way MPI internal buffers are used in particular. We then modified our codes to use more sophisticated nonblocking versions of MPI communication. This significantly improved the performance robustness (independent of the MPI buffering mechanism) and scalability, but at the cost of increased code complexity.
Date: October 10, 2001
Creator: Amestoy, Patrick R.; Duff, Iain S.; L'Excellent, Jean-Yves & Li, Xiaoye S.
System: The UNT Digital Library
Sets of Fourier coefficients using numerical quadrature (open access)

Sets of Fourier coefficients using numerical quadrature

One approach to the calculation of Fourier trigonometric coefficients f(r) of a given function f(x) is to apply the trapezoidal quadrature rule to the integral representation f(r) = {line_integral}{sub 0}{sup 1} f(x)e{sup -2{pi}irx}dx. Some of the difficulties in this approach are discussed. A possible way of overcoming many of these is by means of a subtraction function. Thus, one sets f(x) = h{sub p-1}(x) + g{sub p}(x), where h{sub -1}(x) is an algebraic polynomial of degree p-1, specified in such a way that the Fourier series of g{sub p}(x) converges more rapidly than that of f(x). To obtain the Fourier coefficients of f(x), one uses an analytic expression for those of h{sub p-1}(x) and numerical quadrature to approximately those of g{sub p}(x).
Date: October 10, 2001
Creator: Lyness, J. N.
System: The UNT Digital Library
Chemical genealogy of an atmospheric chemist : James N. Pitts, Jr., a case study. (open access)

Chemical genealogy of an atmospheric chemist : James N. Pitts, Jr., a case study.

None
Date: October 10, 2001
Creator: Gaffney, J. S. & Marley, N. A.
System: The UNT Digital Library
Diurnal variation in water vapor and liquid water profiles from a new microwave profiling radiometer. (open access)

Diurnal variation in water vapor and liquid water profiles from a new microwave profiling radiometer.

None
Date: October 10, 2001
Creator: Wang, J.; Dai, A.; Carlson, D. J.; Ware, R. H. & Liljegren, J. C.
System: The UNT Digital Library
Measurements of beryllium-7 and ozone at Deer Park during the Texas 2000 air quality study. (open access)

Measurements of beryllium-7 and ozone at Deer Park during the Texas 2000 air quality study.

None
Date: October 10, 2001
Creator: Gaffney, J. S. & Marley, N. A.
System: The UNT Digital Library
Simulation of fine-scale soil moisture variations in the Walnut River Watershed in Kansas. (open access)

Simulation of fine-scale soil moisture variations in the Walnut River Watershed in Kansas.

None
Date: October 10, 2001
Creator: Xu, Y. & Wesely, M. L.
System: The UNT Digital Library
Historical overview of the development of chemiluminescence detection and its application to air pollutants. (open access)

Historical overview of the development of chemiluminescence detection and its application to air pollutants.

None
Date: October 10, 2001
Creator: Gaffney, J. S. & Marley, N. A.
System: The UNT Digital Library
Effects of fast chemical reactions on estimated emission fluxes of NO{sub x} from soil. (open access)

Effects of fast chemical reactions on estimated emission fluxes of NO{sub x} from soil.

None
Date: October 10, 2001
Creator: Kotamarthi, V. R. & Wesely, M. L.
System: The UNT Digital Library