CV: Evangelos Miliordos 7/30/14 Curriculum Vitae Evangelos Miliordos Personal information Date of Birth: 7 December 1981 Place of Birth: Athens, Greece Home address: 1900 Stevens Drive, Apt 525 Richland, WA 99354, USA Tel. +1-517-488-2099 e-mail: [email protected] Work address: Physical Sciences Division Pacific Northwest National Laboratory P.O. Box 999, MS K1-83, Richland, WA 99352, USA Tel. +1-509-375-3893 e-mail: [email protected] Personal webpage: http://users.uoa.gr/~emiliord/index.htm Marital status: Single Citizenship: Greek citizen Residence status in USA: Resident alien (H1B status) Education April 2006 - March 2010 National and Kapodistrian University, Athens, Greece Advisor: Prof. Aristides Mavridis Ph.D. granted May 2010 Major : Physical Chemistry Minor : Theoretical Chemistry September 2003 - March 2006 National and Kapodistrian University, Athens, Greece Advisor: Prof. Aristides Mavridis M.Sc. granted March 2006 Major : Physical Chemistry Minor : Theoretical Chemistry September 1999 - September 2003 National and Kapodistrian University, Athens, Greece Diploma in Chemistry granted December 2003 Major: Chemistry 1 CV: Evangelos Miliordos 7/30/14 Professional Employment September 2012 – today Postdoctoral Fellow Molecular Science Research Center Pacific Northwest National Laboratory Richland, Washington USA Research advisor: S. S. Xantheas May 2010 – June 2012 Postdoctoral Fellow Chemistry Department Michigan State University East Lansing, Michigan USA Research advisor: K. L. C. Hunt May 2008 – May 2009 Military Service Greek army September 2006 – June 2007 Teaching Assistant Department of Chemistry National and Kapodistrian University Athens, Greece Fellowships Graduate fellowship, three year fellowship from Hellenic National Scholarships Foundation (I.K.Y.) for postgraduate studies (academic years 2006-2008, 2009-2010). Marie Curie fellowship, Professor Petr Čársky’s laboratory, Heyrovský Institute, Prague, Czech Republic (July – October 2004). Awards and Distinctions – Professional Recognition Undergraduate awards, three times awarded by the Hellenic National Scholarships Foundation (I.K.Y.) for my undergraduate studies performance (1999, 2001, 2002). Outstanding performance award, Fundamental and Computational Sciences Directorate, Pacific Northwest National Laboratory (December 2013). Other Knowledge and skills English, acquisition of the Basic Communication Certificate in English (BCCE) of the University of Michigan. German, Zertifikat Deutsch als Fremdsprache (ZDaF-Grundstufe) of the Goethe Institute. Ability of handling computer systems with both windows and linux operating systems. Programming skills, especially using FORTRAN and Pascal (Delphi development studio). The latter enables the construction of visual windows-based applications. Digital electronics, electronic circuits design and construction. 2 CV: Evangelos Miliordos 7/30/14 Membership in Professional Societies American Chemical Society (ACS), 2013 – present Association of Greek Chemists, 2003 – 2008 Citation Index Web of Knowledge: Google Scholar: Total of 107 citations (as of March 23th, 2014) Total of 133 citations (as of March 23st, 2014) Hirsch index: 6 Hirsch index: 6 Invited Talks at Scientific Institutions 2012 Michigan State University, East Lansing, Michigan, USA; Physical Chemistry Seminar (April 24). 2012 Pacific Northwest National Laboratory, Richland, Washington, USA (May 7). 2012 National Hellenic Research Foundation, Athens, Greece (July 3). 2013 Michigan State University, East Lansing, Michigan, USA; Physical Chemistry Seminar (May 6). 2014 Pacific Northwest National Laboratory, Richland, Washington, USA (April 16). Invited Talks in Scientific Conferences/Meetings 2013 Telluride Science Research Center, “Intermolecular Interactions: New challenges for ab initio Theory”, Telluride, Colorado, USA (July 15 – 19). 2014 Collaborative Workshop in Chemistry at the Interfaces, University of California at Irvine, Laguna Beach, California, USA (January 22 – 23). Participation and Contributed Talks in Scientific Conferences/Meetings 2003 Participant, 8th European Workshop on Quantum Systems in Chemistry and Physics, Spetses, Greece (August 30 – September 4). 2004 Poster presentation, Molecular Quantum Mechanics, The No Nonsense Path to Progress, St. John’s College, Cambridge University, England, UK (July 24 – 29). 2004 Poster presentation, 3rd Central European Symposium on Theoretical Chemistry, Tihany, Balaton, Hungary (September 30 – October 3). 2005 Contributed Talk, 10th European Workshop on Quantum Systems in Chemistry and Physics, Carthage, Tunisia (September 1 – 7). 2006 Poster presentation, 7th International Conference of Computational Methods in Sciences and Engineering, Chania, Crete, Greece (October 30 – November 1). 2009 Oral presentation, 1st Conference of the Graduate Students of the National and Kapodistrian University of Athens, Athens, Greece (March 27 – 28). 2009 Participant, 18th Symposium of the Hellenic Nuclear Physics Society, Athens, Greece (May 29 – 30). 3 CV: Evangelos Miliordos 7/30/14 2011 Poster presentation, DFT 2011, Athens, Greece (August 29 – September 2). 2012 Oral presentation, 2012 Midwest Theoretical Chemistry Conference, Madison, Wisconsin, USA (June 7 – 9). 2013 Oral presentation, 246th American Chemical Society meeting, Indianapolis, Indiana, USA (September 8 – 12). 2014 Contributed Talk, Collaborative Workshop in Chemistry at the Interfaces, University of California Irvine, Laguna Beach, California, USA (January 22 – 23). 2014 Contributed Talk, 247th American Chemical Society meeting, Dallas, Texas, USA (March 16 – 20). 2014 Poster presentation, 2014 Midwest Theoretical Chemistry Conference, Evanston, Illinois, USA (June 15 – 17). 2014 Poster presentation, Telluride Science Research Center, American Conference on Theoretical Chemistry, Telluride, Colorado, USA (July 20 – 24). 2014 Oral presentation, PNNL Post-doc Symposium, Richland, Washington, USA (July 30). 2014 Contributed Talk, 248th American Chemical Society meeting, San Francisco, California, USA (August 10 – 14). Publications in Peer-reviewed Scientific Journals _________________________________________ 2004 _____________________________________ 1. A. Papakondylis, E. Miliordos, and A. Mavridis, “Carbonyl boron and related systems: An ab initio study of B-X and YBBY (1Σg+), where X = He, Ne, Ar, Kr, CO, CS, N2 and Y = Ar, Kr, CO, CS, N2”, Journal Physical Chemistry A. 108, 4335 (2004), DOI: 10.1021/jp031308q. __________________________________________ 2007 ____________________________________ 2. E. Miliordos, and A. Mavridis, “The electronic structure of vanadium oxide. Neutral and charged species, VO0,±”, Journal Physical Chemistry A. 111, 1953 (2007), DOI: 10.1021/jp067451b. 3. E. Miliordos, A. Papakondylis, A. A. Tsekouras, and A. Mavridis, “All-electron first principles calculations of the ground and some low-lying excited states of BaI”, Journal Physical Chemistry A. 111, 10002 (2007), DOI: 10.1021/jp0745788. __________________________________________ 2008 ____________________________________ 4. E. Miliordos, and A. Mavridis, “Ab initio investigation of the electronic structure and bonding of BH, BH⎯, and HBBH molecules”, Journal of Chemical Physics 128, 144308 (2008), DOI: 10.1063/1.2902284. __________________________________________ 2010 ____________________________________ 5. E. Miliordos, and A. Mavridis, “Theoretical study of the early 3d-transition metal diatomic oxides and their ions: ScO0,±, TiO0,±, CrO0,±, MnO0,± ”, Klaus Ruedenberg Special Issue (invited), Journal Physical Chemistry A 114, 8536 (2010), DOI: 10.1021/jp910218u. 6. E. Miliordos, and A. Mavridis, “An accurate first principles study of the geometric and electronic structure of B2, B2¯, B3, B3¯, and B3H. Ground and excited states”, Journal of Chemical Physics 132, 164307 (2010), DOI: 10.1063/1.3389133. 4 CV: Evangelos Miliordos 7. 7/30/14 E. Miliordos, “Hückel versus Möbius aromaticity: The particle in a cylinder versus a Möbius strip”, Physical Review A 82, 062118 (2010), DOI: 10.1103/PhysRevA.82.062118. __________________________________________ 2011 ____________________________________ 8. E. Miliordos, and K. L. C. Hunt, “First principles calculations of the electronic and geometrical structures of neutral [Sc,O,H] molecules and the monocations, ScOH0,+ and HScO0,+”, J. Phys. Chem. A 115, 4436 (2011), DOI: 10.1021/jp110378d. 9. E. Miliordos, “The particle in a Möbius wire and half-integer orbital angular momentum”, Physical Review A 83, 062107 (2011), DOI: 10.1103/PhysRevA.83.062107. 10. C. N. Sakellaris, E. Miliordos, and A. Mavridis, “First principles study of the ground and excited states of FeO, FeO+, and FeO⎯ ”, Journal of Chemical Physics 134, 234308 (2011), DOI: 10.1063/1.3598529. 11. E. Miliordos, J. F. Harrison, and K. L. C. Hunt, “Ab initio investigation of titanium hydroxide isomers and their cations, TiOH0,+ and HTiO0,+ ”, Journal of Chemical Physics 135, 144111 (2011), DOI: 10.1063/1.3644963. __________________________________________ 2012 ____________________________________ 12. X. Li, A. Mandal, E. Miliordos, and K. L. C. Hunt, “Interaction-induced dipoles of hydrogen molecules colliding with helium atoms: A new ab initio dipole surface for high-temperature applications”, Journal of Chemical Physics 136, 044320 (2012), DOI: 10.1063/1.3676406. __________________________________________ 2013 ____________________________________ 13. E. Miliordos, J. F. Harrison, and K. L. C. Hunt, “Ground and excited states of vanadium hydroxide isomers and their cations, VOH0,+ and HVO0,+ ”, Journal of Chemical Physics 138, 114305 (2013), DOI: 10.1063/1.4793744. 14. E. Miliordos and J. F. Harrison, “Hirshfeld density partitioning technique: a first application on transition metal compounds, TiO, VO, ScOH”, Journal of Chemical Physics 138, 184305 (2013), DOI: 10.1063/1.4803478. 15. E. Miliordos, K. Ruedenberg and S. S. Xantheas, “Unusual inorganic biradicals: A Theoretical Analysis”, Communication to the Editor, Angewandte Chemie International Edition 52, 5736 (2013), DOI: 10.1002/anie.201300654. 16. E. Miliordos and S. S. Xantheas, “Efficient procedure for the numerical calculation of harmonic vibrational frequencies based on internal coordinates” Joel M. Bowman Special Issue (invited), Journal of Physical Chemistry A 117, 7019 (2013), DOI: 10.1021/jp3127576. 17. E. Miliordos, E. Aprà and S. S. Xantheas, “Optimal geometries and harmonic vibrational frequencies of the global minima of water clusters (H2O)n, n=2-6, and several hexamer local minima at the CCSD(T) level of theory” Journal of Chemical Physics 139, 114302 (2013), DOI: 10.1063/1.4820448. __________________________________________ 2014 ____________________________________ 18. E. Miliordos and S. S. Xantheas, “Elucidating the mechanism behind the stabilization of multicharged metal cations in water: A case study of the electronic states of microhydrated Mg2+, Ca2+ and Al3+”, Hot article for the week Oct 22, 2013 (http://blogs.rsc.org/cp/2013/10/22/this-weeks-hotarticles-11/), Highlighted in NERSC’s web page, June 2014, http://www.nersc.gov/news- 5 CV: Evangelos Miliordos 7/30/14 publications/news/science-news/2014/thirsty-metals-key-to-longer-battery-lifetimes/. Highlighted in DOE’s Pulse (Science and Technology Highlights from the DOE National Laboratories, #417, 7 July 2014 http://web.ornl.gov/info/news/pulse/no417/story1.shtml. Reported in Science Springs, July 7 2014 http://sciencesprings.wordpress.com/2014/07/07/from-doe-pulse-satisfying-metalsthirst-vital-for-high-capacity-batteries/, Communication to the Editor, Physical Chemistry Chemical Physics 16, 6886 (2014), DOI: 10.1039/c3cp53636j. Journal cover. 19. E. Miliordos and S. S. Xantheas, “Unimolecular and hydrolysis channels for the detachment of water from microsolvated alkaline earth dication (Mg2+, Ca2+, Sr2+, Ba2+) clusters”, Thom H. Dunning Jr. Special Issue (invited), Theoretical Chemistry Accounts 133, 1450 (2014), DOI: 10.1007/s00214-014-1450-4. 20. E. Miliordos and S. S. Xantheas, “On the bonding nature of ozone (O3) and its sulfur-substituted analogues, SO2, OS2, and S3: Correlation between their biradical character and molecular properties” Journal of the American Chemical Society 136, 2808 (2014), DOI: 10.1021/ja410726u. E. Miliordos, E. Aprà and S. S. Xantheas, “Benchmark Theoretical Study of the π−π Binding Energy in the Benzene Dimer” Journal of Physical Chemistry A XX, XXXX (2014), DOI: 10.1021/jp5024235. 21. Other Publications 1. E. Miliordos, "Ab initio calculations on the ethane molecule and its cation", Diploma Thesis, Department of Chemistry, National and Kapodistrian University of Athens, Athens, Greece (2003). 2. E. Miliordos, "Theoretical investigation of the vanadium oxides, VO0,±", Master Thesis, Department of Chemistry, National and Kapodistrian University of Athens, Athens, Greece (2006). 3. E. Miliordos, "Electronic structure of the MO0,± oxides, M = Sc, Ti, Cr, Mn, through ab initio calculations", Ph. D. Thesis, Department of Chemistry, National and Kapodistrian University of Athens, Athens, Greece (2010). 6
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