Directeur de Recherche, Chimie des Matériaux Inorganiques (DCMI)
Tél: +33(0)3 88 10 71 42Bureau: 2026
  • Present and former positions:
  • University of Strasbourg UMR 7504: Strasbourg, France, 2009-01-01 to present | Research Director
  • Institute of Materials and Systems for Sustainability, Nagoya University: Nagoya, Aichi, Japan, 2018-11-01 to present | Professor (full)
  • Computational Materials Science Initiative (CMSI) – The University of Tokyo: Tokyo, Japan, 2010-03-01 to 2018-03-31 | Invited full professor
  • Japan Advanced Institute of Science and Technology (JAIST): Nomi, Ishikawa, Japan, 2009-04-01 to 2012-03-31 | Invited full professor
  • University of Tsukuba: Tsukuba, Ibaraki, Japan, 2002-09-01 to 2008-12-31 | Associate Professor
  • National Institute of Advanced Science and Technology (AIST): Tsukuba, Ibaraki, Japan, 1998-05-01 to 2002-08-31 | NEDO Fellow
  • Max-Planck-Institut fur Festkoerperforschung: Stuttgart, Germany, 1996-05-01 to 1998-04-30 | Post-doc
  • IBM Zurich Research Laboratory: Zurich, ZH, Switzerland, 1995-08-01 to 1996-04-30 | Post-doc
  • Ecole Polytechnique Federale de Lausanne IRRMA: Lausanne, VD, Switzerland, 1995-01-01 to 1995-07-31 | Post-doc (Institut Romand de Recherche Numerique en Physique des Materiaux (IRRMA))

Parcours universitaire

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Recherches actuelles

Renseignez ici les recherches sur lesquelles vous travaillez actuellement.

  • Selected recent publications:
  • F. Pietrucci, M. Boero, W. Andreoni. How natural materials remove heavy metals from water: mechanistic insights from molecular dynamics simulations. Chemical Science, The Royal Society of Chemistry, 12, 2979, (2021). DOI: 10.1039/d0sc06204a
  • Thuy-Quynh Duong, Carlo Massobrio, Guido Ori, Mauro Boero, Évelyne Martin. Thermal conductivity and transport modes in glassy GeTe 4 by first-principles molecular dynamics. Physical Review Materials, American Physical Society, 2019, 3 (10), DOI: 10.1103/PhysRevMaterials.3.105401
  • Synthesis and Characterization of non-IPR Monometallic Actinide Endohedral Metallofullerenes U@C1(17418)-C76, U@C1(28324)-C80 and Th@C1(28324)-C80: New Paradigm in Fullerene Cage Selection.  W. Cai, L. Abella, J. Zhuang, X. Zhang, L. Feng, Y. Wang, R. Morales-Martínez, R. Esper, M. Boero, A. Metta-Magaña, A. Rodríguez-Fortea, J. M. Poblet, L. Echegoyen, N. Chen, J. Am. Chem. Soc. 140, 18039 (2018). DOI 10.1021/jacs.8b10435
  • First-Principles Study of Dissociation Processes for the Synthesis of Fe and Co Oxide Nanoparticles B. Özdamar, A. Bouzid, G. Ori, C. Massobrio, M. Boero, J. Chem. Theory Comput. 14, 225 (2018). DOI 10.1021/acs.jctc.7b00869
  • The role of pi-radicals in the spin connectivity of clusters and networks of Tb double-decker single molecule magnets.  A. Amokrane, S. Klyatskaya, M. Boero, M. Ruben, J-P. Bucher, ACS Nano 11, 10750 (2017). DOI 10.1021/acsnano.7b05804
  • Indirect Four-Electron Oxygen Reduction on Carbon Materials Catalysts.  G.-L. Chai, M. Boero, Z. Hou, K. Terakura, C. Lin, W. Cheng, ACS Catalysis 7, 7908 (2017). DOI 10.1021/acscatal.7b02548