{"id":{"repo_id":"wfu","oai_identifier":"oai:wakespace.lib.wfu.edu:10339/82242"},"canonical_url":"https://search.dev.ndltd.org/etd/wfu/oai:wakespace.lib.wfu.edu:10339/82242","repository":{"repo_id":"wfu","name":"Wake Forest University","base_url":"https://wakespace.lib.wfu.edu/oai/request"},"display":{"title":"Understanding and Improving Hydrogen Storage Materials with Density Functional Theory Methods","abstract":"This work outlines some of the current issues driving the development of methods for using hydrogen as an energy carrier. I argue that suitably storing hydrogen is the key technological challenge to this effort. I describe the technical requirements for what constitutes a suitable hydrogen storage material and explain the three primary mecha- nisms by which these materials can operate. 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I argue that suitably storing hydrogen is the key technological challenge to this effort. I describe the technical requirements for what constitutes a suitable hydrogen storage material and explain the three primary mecha- nisms by which these materials can operate. In many cases, the relevant physical and electronic properties of these materials can be modeled computationally with density functional theory, and I describe some of the myriad assumptions and methods necessary to do that."]},{"key":"dc:title","label":"Title","values":["Understanding and Improving Hydrogen Storage Materials with Density Functional Theory Methods"]}]}],"canonical_facts":{"dc:creator":["Welchman, Evan"],"dc:date.accessioned":["2017-06-15T08:36:12Z"],"dc:date.available":["2018-06-14T08:30:13Z"],"dc:date.issued":["2017"],"dc:description.abstract":["This work outlines some of the current issues driving the development of methods for using hydrogen as an energy carrier. I argue that suitably storing hydrogen is the key technological challenge to this effort. I describe the technical requirements for what constitutes a suitable hydrogen storage material and explain the three primary mecha- nisms by which these materials can operate. In many cases, the relevant physical and electronic properties of these materials can be modeled computationally with density functional theory, and I describe some of the myriad assumptions and methods necessary to do that."],"dc:identifier.uri":["http://hdl.handle.net/10339/82242"],"dc:language.iso":["en"],"dc:publisher":["Wake Forest University"],"dc:title":["Understanding and Improving Hydrogen Storage Materials with Density Functional Theory Methods"],"dc:type":["Dissertation"]},"updated_at":"2026-07-27T22:02:11Z"}