Carlo Gatti

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Leonardo Lo PrestiUniversità degli Studi di MilanoVerified email at unimi.it
Luca BertiniUniversity of Milano-BicoccaVerified email at unimib.it
Professor Muhammet S. ToprakDepartment of Applied Physics, KTH-Royal Institute of TechnologyVerified email at kth.se
Fausto CargnoniConsiglio Nazionale delle RicercheVerified email at istm.cnr.it
Mamoun MuhammedRoyal Institute of TechnologyVerified email at kth.se
Vladimir L. SolozhenkoDirecteur de recherche, CNRSVerified email at lspm.cnrs.fr
Alexandre COURAC (KURAKEVYCH)Associate Professor, IMPMC, Department of Physics, University P&M CurieVerified email at upmc.fr
Matthias WuttigProfessor für Physik, RWTH AachenVerified email at physik.rwth-aachen.de
Richard F. W. BaderProfessor of chemistry, McMaster UniversityVerified email at sbu.ac.ir
Ángel Martín PendásProfesor de Química Física (UOV)Verified email at uniovi.es
Julia Contreras-GarcíaCNRS & Sorbonne UniversitéVerified email at lct.jussieu.fr
Giovanni MacettiUniversità degli Studi Di MilanoVerified email at unimi.it
Preston MacDougallProfessor of Chemistry, Middle Tennessee State UniversityVerified email at mtsu.edu
Jiuhua ChenProfessor of Mechanical and Materials Engineering, Florida International UniversityVerified email at fiu.edu
Philip CoppensDepartment of Chemistry, University at Buffalo, SUNYVerified email at buffalo.edu
Qiang ZhuUniversity of North Carolina at CharlotteVerified email at uncc.edu
Jacob OvergaardDirector, Industrial Materials Technology, Danish Technological InstituteVerified email at teknologisk.dk
Roberto DallocchioCNR ICBVerified email at cnr.it
Victor MamaneChargé de Recherche CNRS, Université de StrasbourgVerified email at unistra.fr
Alessandro DessìCNR-ICBVerified email at cnr.it

Carlo Gatti

Dirigente di Ricerca, CNR-SCITEC, Istituto di Scienze e Tecnologie Chimiche, sezione di via Golgi

Verified email at scitec.cnr.it

Chemical bonding and Bond Quantum Chemical Topology X-ray Charge/Spin Electron Densities Li-batteries systems under pressure


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Ionic high-pressure form of elemental boron AR Oganov, J Chen, C Gatti, Y Ma, Y Ma, CW Glass, Z Liu, T Yu, ... Nature 457 (7231), 863-867, 2009	1038	2009
Crystal field effects on the topological properties of the electron density in molecular crystals: The case of urea C Gatti, VR Saunders, C Roetti The Journal of chemical physics 101 (12), 10686-10696, 1994	868	1994
Chemical bonding in crystals: new directions C Gatti Zeitschrift für Kristallographie-Crystalline Materials 220 (5-6), 399-457, 2005	757	2005
Bond paths as privileged exchange channels AM Pendás, E Francisco, MA Blanco, C Gatti Chemistry–A European Journal 13 (33), 9362-9371, 2007	374	2007
A stable compound of helium and sodium at high pressure X Dong, AR Oganov, AF Goncharov, E Stavrou, S Lobanov, G Saleh, ... Nature Chemistry 9 (5), 440-445, 2017	372	2017
The Impact of Nanostructuring on the Thermal Conductivity of Thermoelectric CoSb₃ MS Toprak, C Stiewe, D Platzek, S Williams, L Bertini, E Müller, C Gatti, ... Advanced Functional Materials 14 (12), 1189-1196, 2004	355	2004
A guided tour through modern charge density analysis C Gatti, P Macchi Modern Charge-Density Analysis, 1-78, 2011	331	2011
XD2006-a computer program package for multipole refinement, topological analysis of charge densities and evaluation of intermolecular energies from experimental and theoretical … A Volkov, P Macchi, LJ Farrugia, C Gatti, P Mallinson, T Richter, ... University at Buffalo, State University of New York, NY, USA, 2006	299*	2006
A quantum‐mechanical map for bonding and properties in solids JY Raty, M Schumacher, P Golub, VL Deringer, C Gatti, M Wuttig Advanced Materials 31 (3), 1806280, 2019	291	2019
A Green's function for the density RFW Bader, C Gatti Chemical physics letters 287 (3-4), 233-238, 1998	272	1998
Properties of atoms in molecules: Dipole moments and transferability of properties RFW Bader, A Larouche, C Gatti, MT Carroll, PJ MacDougall, KB Wiberg The Journal of chemical physics 87 (2), 1142-1152, 1987	263	1987
Evolutionary crystal structure prediction as a method for the discovery of minerals and materials AR Oganov, Y Ma, AO Lyakhov, M Valle, C Gatti Reviews in Mineralogy and Geochemistry 71 (1), 271-298, 2010	243	2010
Direct space representation of the metallic bond B Silvi, C Gatti The Journal of Physical Chemistry A 104 (5), 947-953, 2000	232	2000
Non-covalent interaction via the reduced density gradient: Independent atom model vs experimental multipolar electron densities G Saleh, C Gatti, LL Presti Computational and Theoretical Chemistry 998, 148-163, 2012	228	2012
Revealing non‐covalent interactions in molecular crystals through their experimental electron densities G Saleh, C Gatti, L Lo Presti, J Contreras‐García Chemistry–A European Journal 18 (48), 15523-15536, 2012	225	2012
Evaluation of net atomic charges and atomic and molecular electrostatic moments through topological analysis of the experimental charge density A Volkov, C Gatti, Y Abramov, P Coppens Acta Crystallographica Section A: Foundations of Crystallography 56 (3), 252-258, 2000	224	2000
On the presence of non-nuclear attractors in the charge distributions of Li and Na clusters WL Cao, C Gatti, PJ MacDougall, RFW Bader Chemical physics letters 141 (5), 380-385, 1987	220	1987
On the origin of topological differences between experimental and theoretical crystal charge densities A Volkov, Y Abramov, P Coppens, C Gatti Acta Crystallographica Section A: Foundations of Crystallography 56 (4), 332-339, 2000	208	2000
Charge density topological study of bonding in lithium clusters: Part I: Planar Li_n clusters (n=4, 5, 6) C Gatti, P Fantucci, G Pacchioni Theoretica chimica acta 72, 433-458, 1987	208	1987
Chemical information from the source function C Gatti, F Cargnoni, L Bertini Journal of computational chemistry 24 (4), 422-436, 2003	196	2003

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