The high-throughput highway to computational materials design S Curtarolo, GLW Hart, MB Nardelli, N Mingo, S Sanvito, O Levy
Nature materials 12 (3), 191-201, 2013
1991 2013 Towards molecular spintronics AR Rocha, VM Garcia-Suarez, SW Bailey, CJ Lambert, J Ferrer, S Sanvito
Nature materials 4 (4), 335-339, 2005
1434 2005 Molecular spintronics S Sanvito
Chemical Society Reviews 40 (6), 3336-3355, 2011
1326 2011 AFLOWLIB. ORG: A distributed materials properties repository from high-throughput ab initio calculations S Curtarolo, W Setyawan, S Wang, J Xue, K Yang, RH Taylor, LJ Nelson, ...
Computational Materials Science 58, 227-235, 2012
1108 2012 Liquid exfoliation of solvent-stabilized few-layer black phosphorus for applications beyond electronics D Hanlon, C Backes, E Doherty, CS Cucinotta, NC Berner, C Boland, ...
Nature communications 6 (1), 8563, 2015
1104 2015 Solvent exfoliation of transition metal dichalcogenides: dispersibility of exfoliated nanosheets varies only weakly between compounds G Cunningham, M Lotya, CS Cucinotta, S Sanvito, SD Bergin, R Menzel, ...
ACS nano 6 (4), 3468-3480, 2012
792 2012 Spin and molecular electronics in atomically generated orbital landscapes AR Rocha, VM García-Suárez, S Bailey, C Lambert, J Ferrer, S Sanvito
Physical Review B—Condensed Matter and Materials Physics 73 (8), 085414, 2006
781 2006 Revealing the role of organic cations in hybrid halide perovskite CH3NH3PbI3 C Motta, F El-Mellouhi, S Kais, N Tabet, F Alharbi, S Sanvito
Nature communications 6 (1), 1-7, 2015
697 2015 Hybrid graphene and graphitic carbon nitride nanocomposite: gap opening, electron–hole puddle, interfacial charge transfer, and enhanced visible light response A Du, S Sanvito, Z Li, D Wang, Y Jiao, T Liao, Q Sun, YH Ng, Z Zhu, ...
Journal of the American Chemical Society 134 (9), 4393-4397, 2012
607 2012 Possible doping strategies for MoSab initio study K Dolui, I Rungger, C Das Pemmaraju, S Sanvito
Physical Review B—Condensed Matter and Materials Physics 88 (7), 075420, 2013
603 2013 The rise of spinterface science S Sanvito
Nature Physics 6 (8), 562-564, 2010
486 2010 Ferromagnetism Driven by Intrinsic Point Defects in C Das Pemmaraju, S Sanvito
Physical review letters 94 (21), 217205, 2005
445 2005 Self-interaction errors in density-functional calculations of electronic transport C Toher, A Filippetti, S Sanvito, K Burke
Physical Review Letters 95 (14), 146402, 2005
423 2005 The role of anharmonic phonons in under-barrier spin relaxation of single molecule magnets A Lunghi, F Totti, R Sessoli, S Sanvito
Nature communications 8 (1), 14620, 2017
389 2017 Charge carrier mobility in hybrid halide perovskites C Motta, F El-Mellouhi, S Sanvito
Scientific reports 5 (1), 12746, 2015
387 2015 General Green’s-function formalism for transport calculations with S Sanvito, CJ Lambert, JH Jefferson, AM Bratkovsky
Physical Review B 59 (18), 11936, 1999
380 1999 First-principles study of the origin and nature of ferromagnetism in S Sanvito, P Ordejon, NA Hill
Physical Review B 63 (16), 165206, 2001
366 2001 Basal-plane functionalization of chemically exfoliated molybdenum disulfide by diazonium salts KC Knirsch, NC Berner, HC Nerl, CS Cucinotta, Z Gholamvand, N McEvoy, ...
ACS nano 9 (6), 6018-6030, 2015
354 2015 Algorithm for the construction of self-energies for electronic transport calculations based on singularity elimination and singular value decomposition I Rungger, S Sanvito
Physical Review B—Condensed Matter and Materials Physics 78 (3), 035407, 2008
353 2008 First-principles prediction of a room-temperature ferromagnetic Janus VSSe monolayer with piezoelectricity, ferroelasticity, and large valley polarization C Zhang, Y Nie, S Sanvito, A Du
Nano letters 19 (2), 1366-1370, 2019
335 2019 
Ivan RunggerNational Physical Laboratory在 npl.co.uk 的电子邮件经过验证
