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Abstract Book: Software Development and Layout: Rocco De Marco Welcome Welcome to Camerino! The conference organizers, together with the University of Camerino and all the institutional sponsors of the inter- national XAFS 14 conference are proud to have you all again in Italy, site of the first international conference on EXAFS and Near Edge structure held in Frascati, 1982, after the initial weekend meeting taking place at Daresbury in 1981. After more than three decades, the world, and science of course, changed very much. The x-ray absorption spec- troscopy (XAS) transformed from a “new” and sometimes misused technique to a more mature tool for deeper and deeper investigations of structural and electronic properties of matter. The potential of this technique remains now particularly high and new perspectives are opened by advances in experimental and theoretical methods and by new radiation sources. The continuous interest in developing and using XAS is clearly shown by the success of the XAFS conference series and by this conference in particular, with about 500 participants from all over the world regularly registered, probably the largest participation ever recorded for this event. An innovative format of the conference containing symposia on specific topics of large interest, the presence of numerous excellent invited speakers, and the extremely high number of first-class contributed abstracts, guarantee a truly interesting scientific program which we are proud of. The choice of Camerino as a XAFS conference site deserves also a few lines of comments. Camerino is a quiet “hidden” historical town, outside of the usual touristic routes in Italy, which certainly deserves the journey, as you may soon appreciate. Being one of the oldest Universities in Italy and Europe, it hosted also, since the 70s, several researchers working around the exploitation of synchrotron radiation of the ADONE storage ring in Frascati. The XAS group in Camerino, in charge of organizing this conference, grew about 20 years ago around this original seed. In recent times, the University of Camerino followed the general negative trend related to the decrease of resources devoted to basic research and to the educational system, but both a high-level scientific and teaching activities still stand with about 10000 students attending various courses in different fields. You will see, looking at the good University infrastructures and experienced personnel, at the wonderful landscapes and old monuments, tasting the genuine food and meeting this wonderful people that it is worthwhile to keep a strong scientific tradition in this place. The Marche region around Camerino offers a variety of opportunities for tourism ranging from the seaside to the hills and mountains of the interior, with many nice historical towns. This is a lively region that has developed a system of small to medium enterprises featuring a particularly high capacity for creativity in fashion and manufacturing ranging from clothing to home appliances, without forgetting the need of a high-level educational system. We are confident that you will appreciate the nice and friendly environment of this conference, that can stimulate many occasions of fruitful meeting and conversations among scientists all day long and while attending pleasant and interesting social events. We hereby welcome you to an exciting conference that we hope you will all remember at the same time as fruitful and pleasant. On behalf of the Organizing Committee Andrea Di Cicco Chairman of the Conference 1 Chairman of the conference Andrea Di Cicco Co-chair Adriano Filipponi International advisory committee Klaus Baberschke, Germany Grant Bunker, USA Majed Chergui, Switzerland Frank De Groot, Netherland John Evans, UK Roger Falcone, USA Francois Farges, France Ronald Frahm, Germany Joaquin Garcia, Spain Graham N. George, Canada Pieter Glatzel, France Britt Hedman, USA Elisabeth Holub-Krappe, Germany Peter A. Lay, Australia Alain Manceau, France Alfons Molenbroek, Denmark Calogero R. Natoli, Italy Matt Newville, USA Hiroyuki Oyanagi, Japan Bruce Ravel, USA John Rehr, USA Mark Ridgway, Australia Dipankar Das Sarma, India Tsun-Kong Sham, Canada Alexander Soldatov, Russia Toshihiko Yokoyama, Japan Ziyu Wu, China Program committee Maurizio Benfatto, LNF-INFN Federico Boscherini, Universit`adi Bologna Paola D’Angelo, Universit`adi Roma “La Sapienza” Paolo Fornasini, Universit`adi Trento Carlo Lamberti, Universit`adi Torino Silvia Morante, Universit`adi Roma Tor Vergata Calogero Renzo Natoli, LNF-INFN Simona Quartieri, Universit`adi Messina Settimio Mobilio, Universit`adi Roma Tre Giorgio Paolucci, ELETTRA, Trieste Giovanni Stefani, Universit`adi Roma Tre Local organizing committee Emiliano Principi Angela Trapananti Rocco De Marco Marco Minicucci Yvonne Soldo Andrea Perali Agnieszka Witkowska Francesco Nobili Mamatimin Abbas Giorgia Greco Eleonora Paris Gabriele Giuli Roberto Gunnella Secretary Fiorella Paino Valeria Quacquarini Lia Sabatini Rita Bertelli Romina Skabar Technical Support Franco Bizzarri Tiziano Gabrielli Venanzo Mocci Giuseppe Monteneri Additional Staff M. Rita Cicconi Erika Giangrisostomi Fabio Iesari Valentina Migliorati Marco Murri Ali Mushtaq M. Alberto Picchio Leonardo Properzi Shah Said Karim Lubna Tabassam Andrea Zitolo University support and communications Egizia Marzocco Milena Rossini Michela Tozzi Francesca Magni Graphics and photos Monica Straini Giulio Gentilucci Marco Montecchiari Mario Severini 2 SUNDAY 26 13.00/23.00 19.00/23.00 Reception at Benedetto XIII Welcome party at the Ducal Palace MONDAY 27 Ge2Sb2Te5 ( GST) correlation between the Ag site and the Location: Benedetto XIII 17.00 Spezia Riccardo photoluminescence emission. Molecular dynamics to rationalize EXAFS P2.2 Extreme conditions Allara e Grosso 8.30 Conference opening experiments: a dynamical model explaining 18.00 Itié Jean-Paul hydration behaviour across the lanthanoids(III) High pressure x-ray absorption 9.00/10.30 Plenary session M1 series spectroscopy: energy dispersive versus 9.00 Sarma D. D. 17.15 Migliorati Valentina classical set-up EXAFS and NEXAFS studies of strongly Ion hydration in high-density water 18.20 Baudelet François correlated electron systems P1.3 Instrumentation Aula Aranjo Ruiz Magnetism and structure under extreme 9.45 Kotani Akio 15.30 Frenkel Anatoly condition Theoretical and experimental study of high- Combined XAFS/XRD instrument at the X18A 18.40 Pellicer-Porres Julio magnetic-field XMCD spectra at the L2,3 beamline at NSLS for in situ, time-resolved X-ray absorption study of CuGaO2 and absorption edges of mixed-valence rare-earth catalysis research CuAlO2 delafossites under high pressure compounds 15.50 Fonda Emiliano 19.00 Aquilanti Giuliana First results at SAMBA the SOLEIL hard x-ray Melting in the diamond anvil cell using 11.00/13.00 Symposium S1 beamline for EXAFS and QEXAFS experiments energy dispersive XAS Electronic correlations, corehole interaction and 16.10 Kleimenov Evgueni 19.15 Ramos Aline relaxation effects in x-ray absorption HERFD XAS / RIXS spectrometer Pressure induced metal-insulator transition spectra 16.30 Rocca Francesco in LaMnO3 11.00 Kruger Peter Nano-scale X-ray absorption spectroscopy 19.30 Pylkkänen Tuomas Multiplet couplings and band structure in using XEOL-SNOM detection mode High-pressure ices VI-VIII studied with x-ray L2,3-edge absorption through 16.45 Silversmit Geert Raman scattering multi-channel multiple scattering theory Polycapillary based µ-XAS and 19.45 Peyrusse Olivier 11.25 Taranukhina Anna confocal µ-XANES at a bending K-edge absorption spectra in Warm Dense Multichannel Green's function multiple magnet source of the ESRF Matter scattering calculations of x-ray absorption 17.00 Marcelli Augusto P2.3 Chemistry Aula Aranjo Ruiz 11.50 Ebert Hubert Time-resolved simultaneous spectroscopies 18.00 Frank Patrick Theoretical description of X-ray absorption as a probe of physical-chemical processes The XAS model of dissolved Cu(II) and its in correlated magnetic solids 17.15 Zhang Ke significance to biological electron transfer 12.15 Ikeno Hidekazu Very sensitive X-ray fluorescence analyzer 18.30 Giorgetti Marco Ab-initio CI calculations for 3d transition detector EXAFS and XANES Simulations of Fe/Co metal L2,3 x-ray absorption spectra P1.4 Theory I Aula Betti hexacyanoferrate spectra by GNXAS and 12.40 Shirley Eric 15.30 Fujikawa Takashi MXAN Exotic effects in near-edge spectra Relativistic many-body XMCD theory 18.45 Tenderholt Adam including core degenerate effects Sulfur K-edge x-ray absorption spectroscopy 11.30/13.30 Poster Session PS1 15.50 Harada Isao and density functional theory calculations Theory of XAS and XMCD for field-controlled on molybdenum tris(dithiolene) complexes: 15.30/17.30 Location: Ducal Palace valence mixed states in RE compounds XAS as a probe of electronic and geometric P1.1 Material Science I Sala La Muta 16.10 Hatada Keisuke structures 15.30 Wei Shiqiang Full potential multiple scattering for core 19.00 Provost Karine Experimental and theoretical investigations electron spectroscopies Coupling CP-MD simulations and x-ray on ferromagnetic nature of dilute magnetic 16.30 Joly Yves absorption spectroscopy: exploring the semiconductors Self-consistency, Hubbard, spin-orbit and structure of oxaliplatin in aqueous solution. 15.50 Lawniczak-Jablonska Krystyna other advances in the FDMNES code to 19.15 Jalilehvand Farideh The influence of high temperature annealing simulate XANES and RXD experiments Cadmium(II) complex formation with procedures on the location of Mn inside the 16.50 Sébilleau Didier cysteine,
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