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|a (TOE)ost1771795
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|a (TOE)1771795
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|a E 1.99:doe-umich-05er15686
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|a E 1.99:doe-umich-05er15686
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|a doe-umich-05er15686
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|a Final technical report
|h [electronic resource]
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|a Washington, D.C. :
|b United States. Department of Energy. Office of Science ;
|a Oak Ridge, Tenn. :
|b Distributed by the Office of Scientific and Technical Information, U.S. Department of Energy,
|c 2021.
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|a Medium: ED :
|b digital, PDF file.
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|a text
|b txt
|2 rdacontent.
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|a computer
|b c
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|a online resource
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|a Published through Scitech Connect.
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|a 03/19/2021.
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|a "doe-umich-05er15686."
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|a Linic, Suljo (ORCID:0000000321536755);
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|a Univ. of Michigan, Ann Arbor, MI (United States)
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|a Solid surfaces act as catalysts for many important chemical processes, including commodity chemicals production, energy conversion and pollution mitigation. The outcome of catalytic processes is mainly governed by interactions of adsorbates with active sites on the catalyst surface. These interactions can be dramatically affected by the changes in the local characteristics of the active site, which can be accomplished by an introduction of various promoters and poisons, or by alloying with other metal atoms. In fact, many commercial heterogeneous catalysts contain metal nanoparticles promoted by various additives. Our goal is to develop fundamental understanding about the impact of perturbations in the local geometry of a catalytic site on the local surface reactivity. These insights are crucial for a more systematic and rational catalyst design. The project aims to advance the field of catalysis by formulating reliable structure/performance relationships and utilizing these relationships to identify novel catalytic materials. Benefits for DOE and our society are in the development of fundamental theories that guide the process of discovery of energy-efficient and environmentally friendly heterogeneous catalysis.
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|b FG02-05ER15686.
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|a 36 materials science
|2 local.
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|a Catalysis, electrocatalysis, surface chemistry, chemisorption, alloys, fuel cells
|2 local.
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|a United States. Department of Energy. Office of Science.
|4 spn.
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|a United States.
|b Department of Energy.
|b Office of Scientific and Technical Information
|4 dst.
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|u https://www.osti.gov/servlets/purl/1771795
|z Full Text (via OSTI)
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|a .b118722724
|b 06-23-21
|c 06-23-21
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|a University of Colorado Boulder
|b Online
|c Online
|d Online
|e E 1.99:doe-umich-05er15686
|h Superintendent of Documents classification
|i web
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