Publications of Luca M. Ghiringhelli

Journal Article (60)

2017
Journal Article
Seshaditya, A., Luca M. Ghiringhelli and Luigi Delle Site: Levy-Lieb-Based Monte Carlo Study of the Dimensionality Behaviour of the Electronic Kinetic Functional.
Journal Article
Yu, Chongqi, Wolfgang Harbich, Luca Sementa, Luca M. Ghiringhelli, Edoardo Aprá, Mauro Stener, Alessandro Fortunelli and Harald Brune: Erratum: “Intense fluorescence of Au20” [J. Chem. Phys147, 074301 (2017)].
Journal Article
Yu, Chongqi, Wolfgang Harbich, Luca Sementa, Luca M. Ghiringhelli, Edoardo Apra, Mauro Stener, Alessandro Fortunelli and Harald Brune: Intense fluorescence of Au20.
2016
Journal Article
Reilly, Anthony M., Richard I. Cooper, Claire S. Adjiman, Saswata Bhattacharya, A.Daniel Boese, Jan Gerit Brandenburg, Peter J. Bygrave, Rita Bylsma, Josh E. Campbell, Roberto Car, David H. Case, Renu Chadha, Jason C. Cole, Katherine Cosburn, Herma M. Cuppen, Farren Curtis, Graeme M. Day, Robert A. DiStasio Jr, Alexander Dzyabchenko, Bouke P. van Eijck, Dennis M. Elking, Joost A. van den Ende, Julio C. Facelli, Marta B. Ferraro, Laszlo Fusti-Molnar, Christina-Anna Gatsiou, Thomas S. Gee, René de Gelder, Luca M. Ghiringhelli, Hitoshi Goto, Stefan Grimme, Rui Guo, Detlef W.M. Hofmann, Johannes Hoja, Rebecca K. Hylton, Luca Iuzzolino, Wojciech Jankiewicz, Daniël T. de Jong, John Kendrick, Niek J.J. de Klerk, Hsin-Yu Ko, Liudmila N. Kuleshova, Xiayue Li, Sanjaya Lohani, Frank J.J. Leusen, Albert M. Lund, Jian Lv, Yanming Ma, Noa Marom, Artëm E. Masunov, Patrick McCabe, David P. McMahon, Hugo Meekes, Michael P. Metz, Alston J. Misquitta, Sharmarke Mohamed, Bartomeu Monserrat, Richard J. Needs, Marcus A. Neumann, Jonas Nyman, Shigeaki Obata, Harald Oberhofer, Artem R. Oganov, Anita M. Orendt, Gabriel I. Pagola, Constantinos C. Pantelides, Chris J. Pickard, Rafal Podeszwa, Louise S. Price, Sarah L. Price, Angeles Pulido, Murray G. Read, Karsten Reuter, Elia Schneider, Christoph Schober, Gregory P. Shields, Pawanpreet Singh, Isaac J. Sugden, Krzysztof Szalewicz, Christopher R. Taylor, Alexandre Tkatchenko, Mark E. Tuckerman, Francesca Vacarro, Manolis Vasileiadis, Alvaro Vazquez-Mayagoitia, Leslie Vogt, Yanchao Wang, Rona E. Watson, Gilles A. de Wijs, Jack Yang, Qiang Zhu and Colin R. Groom: Report on the sixth blind test of organic crystal structure prediction methods.
2015
Journal Article
Bhattacharya, Saswata, Benjamin H. Sonin, Christopher J. Jumonville, Luca M. Ghiringhelli and Noa Marom: Computational design of nanoclusters by property-based genetic algorithms: Tuning the electronic properties of (TiO2 )n clusters.
Journal Article
Ghiringhelli, Luca M. and Sergey V. Levchenko: Strengthening gold-gold bonds by complexing gold clusters with noble gases.
Journal Article
Ghiringhelli, Luca M., Jan Vybiral, Sergey V. Levchenko, Claudia Draxl and Matthias Scheffler: Big Data of Materials science: Critical Role of the Descriptor.
Journal Article
2014
Journal Article
Beret, Elizabeth C., Merel van Wijk and Luca M. Ghiringhelli: Reaction cycles and poisoning in catalysis by gold clusters: a thermodynamics approach.
Journal Article
Bhattacharya, Saswata, Sergey V. Levchenko, Luca M. Ghiringhelli and Matthias Scheffler: Efficient ab initio schemes for finding thermodynamically stable and metastable atomic structures: benchmark of cascade genetic algorithms.
Journal Article
Peköz, Rengin, Svenja Wörner, Luca M. Ghiringhelli and Davide Donadio: Trends in the Adsorption and Dissociation of Water Clusters on Flat and Stepped Metallic Surfaces.
Journal Article
Peng, Yang, Luca M. Ghiringhelli and Heiko Appel: A quantum reactive scattering perspective on electronic nonadiabaticity.
2013
Journal Article
Bhattacharya, Saswata, Sergey V. Levchenko, Luca M. Ghiringhelli and Matthias Scheffler: Stability and metastability of clusters in a reactive atmosphere: Theoretical evidence for unexpected stoichiometries of MgMOx.
Journal Article
Delle Site, Luigi, Luca M. Ghiringhelli and David M. Ceperley: Electronic energy functionals: Levy–Lieb principle within the ground state path integral quantum Monte Carlo.
Journal Article
Ghiringhelli, Luca M., Philipp Gruene, Jonathan T. Lyon, David M. Rayner, Gerard Meijer, André Fielicke and Matthias Scheffler: Not so loosely bound rare gas atoms: finite-temperature vibrational fingerprints of neutral gold-cluster complexes.
2012
Journal Article
Donadio, Davide, Luca M. Ghiringhelli and Luigi Delle Site: Autocatalytic and Cooperatively Stabilized Dissociation of Water on a Stepped Platinum Surface.
2011
Journal Article
Beret, Elizabeth C., Luca M. Ghiringhelli and Matthias Scheffler: Free gold clusters: beyond the static, monostructure description.
Journal Article
Carlsson, Johan M., Luca M. Ghiringhelli and Annalisa Fasolino: Theory and hierarchical calculations of the structure and energetics of [0001] tilt grain boundaries in graphene.
Journal Article
Scipioni, R., Davide Doandio, Luca M. Ghiringhelli and Luigi Delle Site: Proton Wires via One-Dimensional Water Chains Adsorbed on Metallic Steps.
2009
Journal Article
Li, Tianshu, Davide Donadio, Luca M. Ghiringhelli and Giulia Galli: Surface-induced crystallization in supercooled tetrahedral liquids.
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