Utah State University DigitalCommons@USU All Graduate Theses and Dissertations Graduate Studies 12-2010 Ab Initio Search for Novel BxHy Building Blocks with Potential for Hydrogen Storage Jared K. Olson Utah State University Follow this and additional works at: https://digitalcommons.usu.edu/etd Part of the Physical Chemistry Commons Recommended Citation Olson, Jared K., "Ab Initio Search for Novel BxHy Building Blocks with Potential for Hydrogen Storage" (2010). All Graduate Theses and Dissertations. 844. https://digitalcommons.usu.edu/etd/844 This Dissertation is brought to you for free and open access by the Graduate Studies at DigitalCommons@USU. It has been accepted for inclusion in All Graduate Theses and Dissertations by an authorized administrator of DigitalCommons@USU. For more information, please contact
[email protected]. AB INITIO SEARCH FOR NOVEL BXHY BUILDING BLOCKS WITH POTENTIAL FOR HYDROGEN STORAGE by Jared K. Olson A dissertation submitted in partial fulfillment of the requirements for the degree of DOCTOR OF PHILOSOPHY in Chemistry (Physical Chemistry) Approved: Dr. Alexander I. Boldyrev Dr. Steve Scheiner Major Professor Committee Member Dr. David Farrelly Dr. Stephen Bialkowski Committee Member Committee Member Dr. T.C. Shen Byron Burnham Committee Member Dean of Graduate Studies UTAH STATE UNIVERSITY Logan, Utah 2010 ii Copyright © Jared K. Olson 2010 All Rights Reserved iii ABSTRACT Ab Initio Search for Novel BxHy Building Blocks with Potential for Hydrogen Storage by Jared K. Olson, Doctor of Philosophy Utah State University, 2010 Major Professor: Dr. Alexander I. Boldyrev Department: Chemistry and Biochemistry On-board hydrogen storage presents a challenging barrier to the use of hydrogen as an energy source because the performance of current storage materials falls short of platform requirements.