Search Results - "Bryan, Charles R"

First-Principles Structural, Mechanical, and Thermodynamic Calculations of the Negative Thermal Expansion Compound Zr2(WO4)(PO4)2 by Weck, Philippe F, Kim, Eunja, Gordon, Margaret E, Greathouse, Jeffery A, Dingreville, Rémi, Bryan, Charles R

“…The negative thermal expansion (NTE) material Zr2(WO4)­(PO4)2 has been investigated for the first time within the framework of the density functional…”
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Infrared and Raman spectroscopy of α‐ZrW2O8: A comprehensive density functional perturbation theory and experimental study by Weck, Philippe F., Gordon, Margaret E., Greathouse, Jeffery A., Bryan, Charles R., Meserole, Stephen P., Rodriguez, Mark A., Payne, Clay, Kim, Eunja

“…Cubic zirconium tungstate (α‐ZrW2O8), a well‐known negative thermal expansion material, has been investigated within the framework of density functional…”
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Elucidating Structure–Spectral Property Relationships of Negative Thermal Expansion Zr2(WO4)(PO4)2: A First-Principles Study with Experimental Validation by Weck, Philippe F, Kim, Eunja, Gordon, Margaret E, Greathouse, Jeffery A, Meserole, Stephen P, Bryan, Charles R

“…The phonon, infrared, and Raman spectroscopic properties of zirconium tungsten phosphate, Zr2(WO4)­(PO4)2 (space group Pbcn, IT No. 60; Z = 4), have been…”
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Oedometric Small-Angle Neutron Scattering: In Situ Observation of Nanopore Structure During Bentonite Consolidation and Swelling in Dry and Hydrous CO2 Environments by Dewers, Thomas A, Heath, Jason E, Bryan, Charles R, Mang, Joseph T, Hjelm, Rex P, Ding, Mei, Taylor, Mark

“…Results of oedometric consolidation experiments linked with small-angle neutron scattering (SANS) measurements are presented, using SWy-2 Wyoming bentonite…”
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Oedometric Small-Angle Neutron Scattering: In Situ Observation of Nanopore Structure During Bentonite Consolidation and Swelling in Dry and Hydrous CO 2 Environments by Dewers, Thomas A, Heath, Jason E, Bryan, Charles R, Mang, Joseph T, Hjelm, Rex P, Ding, Mei, Taylor, Mark

“…Results of oedometric consolidation experiments linked with small-angle neutron scattering (SANS) measurements are presented, using SWy-2 Wyoming bentonite…”
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Adsorption and capillary condensation in porous media as a function of the chemical potential of water in carbon dioxide by Heath, Jason E., Bryan, Charles R., Matteo, Edward N., Dewers, Thomas A., Wang, Yifeng, Sallaberry, Cédric J.

“…The chemical potential of water may play an important role in adsorption and capillary condensation of water under multiphase conditions at geologic CO2…”
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First-Principles Structural, Mechanical, and Thermodynamic Calculations of the Negative Thermal Expansion Compound Zr 2 (WO 4 )(PO 4 ) 2 by Weck, Philippe F, Kim, Eunja, Gordon, Margaret E, Greathouse, Jeffery A, Dingreville, Rémi, Bryan, Charles R

“…The negative thermal expansion (NTE) material Zr (WO )(PO ) has been investigated for the first time within the framework of the density functional…”
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Feldspar dissolution rates in the Topopah Spring Tuff, Yucca Mountain, Nevada by Bryan, Charles R., Helean, Katheryn B., Marshall, Brian D., Brady, Patrick V.

“…Two different field-based methods are used here to calculate feldspar dissolution rates in the Topopah Spring Tuff, the host rock for the proposed nuclear…”
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GreenSight: IoT-Based Greenhouse Monitoring System by Fabian, Charles Bryan R., Sumalinog, Jerson S., Vicente, Paul John S., Joan Katherine, N. Romasanta

“…Greenhouse agriculture has emerged as a critical component in addressing global food security challenges, experiencing rapid growth and technological…”
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Extraction Parameters and Capillary Electrophoresis Analysis of Limonin Glucoside and Phlorin in Citrus Byproducts by Braddock, Robert J, Bryan, Charles R

“…Limonin glucoside (LG) and phlorin were extracted from citrus fruit tissues and assayed by capillary electrophoresis (CE). LG was determined in dried [1.20 ±…”
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Development of a consistent geochemical model of the Mg(OH)2–MgCl2–H2O system from 25°C to 120°C by Knight, Andrew W., Bryan, Charles R., Jové-Colón, Carlos F.

“…The formation of magnesium chloride-hydroxide salts (magnesium hydroxychlorides) has implications for many geochemical processes and technical applications…”
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Radionuclide incorporation in negative thermal expansion α-Zr(WO4)2: A density functional theory study by Kim, Eunja, Weck, Philippe F., Greathouse, Jeffery A., Gordon, Margaret E., Bryan, Charles R.

“…[Display omitted] •DFT study of radionuclide (U, Pu, Tc) incorporation in negative thermal expansion Zr(WO4)2. The incorporation of uranium, plutonium and…”
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Assessing exchange-correlation functionals for elasticity and thermodynamics of α-ZrW2O8: A density functional perturbation theory study by Weck, Philippe F., Kim, Eunja, Greathouse, Jeffery A., Gordon, Margaret E., Bryan, Charles R.

“…[Display omitted] •Elastic and thermodynamic properties of α-ZrW2O8 were investigated with DFPT.•PBEsol and PBE exchange-correlation functionals were…”
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Radionuclide incorporation in negative thermal expansion α -Zr(WO4)2: A density functional theory study by Kim, Eunja, Weck, Philippe F., Greathouse, Jeffery A., Gordon, Margaret E., Bryan, Charles R.

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Altering wettability to recover more oil from tight formations by Brady, Patrick V., Bryan, Charles R., Thyne, Geoffrey, Li, Huina

“…•Experimental measurements show that solution pH, salinity, and hardness control adhesion of oil to the middle Bakken.•Chemical controls over wettability…”
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Considerations for realistic atmospheric environments: An application to corrosion testing by Katona, R.M., Knight, A.W., Maguire, M., Bryan, C.R., Schaller, R.F.

“…Measured salt compositions in dust collected over roughly the last decade from surfaces of in-service stainless-steel alloys at four locations around the…”
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Elucidating Structure–Spectral Property Relationships of Negative Thermal Expansion Zr 2 (WO 4 )(PO 4 ) 2 : A First-Principles Study with Experimental Validation by Weck, Philippe F., Kim, Eunja, Gordon, Margaret E., Greathouse, Jeffery A., Meserole, Stephen P., Bryan, Charles R.

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Assessing exchange-correlation functionals for elasticity and thermodynamics of α - ZrW 2 O 8 : A density functional perturbation theory study by Weck, Philippe F., Kim, Eunja, Greathouse, Jeffery A., Gordon, Margaret E., Bryan, Charles R.

“…Elastic and thermodynamic properties of negative thermal expansion (NTE) αα-ZrW2O8 have been calculated using PBEsol and PBE exchange-correlation functionals…”
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Capillary Electrophoresis Analysis of Orange Juice Pectinesterases by Braddock, Robert J, Bryan, Charles R, Burns, Jacqueline K

“…Pectinesterase (PE) was extracted from orange juice and pulp with 1 M NaCl, desalted, and separated using capillary electrophoresis (CE) gel procedures…”
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Use of in situ Raman spectroelectrochemical technique to explore atmospheric corrosion in marine-relevant environments by Katona, R.M., Kelly, R.G., Bryan, C.R., Schaller, R.F., Knight, A.W.

“…[Display omitted] •In-situ Raman for simulated atmospheric environments.•Boundary layer control in Raman cell.•Solution regeneration needed to prevent oxygen…”
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