Publications S3-NANO | CNR Istituto Nanoscienze

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Accurate ab initio tight-binding Hamiltonians: Effective tools for electronic transport and optical spectroscopy from first principles; D'Amico P., Agapito L., Catellani A., Ruini A., Curtarolo S., Fornari M., Nardelli M.B., Calzolari A.; Physical Review B (94); 165166 (2016) 10.1103/PhysRevB.94.165166

Predicting signatures of anisotropic resonance energy transfer in dye-functionalized nanoparticles; Gil G., Corni S., Delgado A., Bertoni A., Goldoni G.; RSC Advances (6); 104648-104656 (2016) 10.1039/c6ra22433d

Observation of Tunneling-Assisted Highly Forbidden Single-Photon Transitions in a Ni4 Single-Molecule Magnet; Chen Y., Ashkezari M., Collett C., Allão Cassaro R., Troiani F., Lahti P., Friedman J.; Physical Review Letters (117); 187202 (2016) 10.1103/PhysRevLett.117.187202

Correlation Effects in Scanning Tunneling Microscopy Images of Molecules Revealed by Quantum Monte Carlo; Barborini M., Sorella S., Rontani M., Corni S.; Journal of Chemical Theory and Computation (12); 5339-5349 (2016) 10.1021/acs.jctc.6b00710

Direct electrical control of IgG conformation and functional activity at surfaces; Ghisellini P., Caiazzo M., Alessandrini A., Eggenhöffner R., Vassalli M., Facci P.; Scientific Reports (6); 37779 (2016) 10.1038/srep37779

Potential use of nanomedicine for drug delivery across the blood-brain barrier in healthy and diseased brain; Ruozi B., Belletti D., Pederzoli F., Forni F., Vandelli M.A., Tosi G.; CNS and Neurological Disorders - Drug Targets (15); 1079-1091 (2016) 10.2174/1871527315666160915112210

The substrate is a pH-controlled second gate of electrolyte-gated organic field-effect transistor; Di Lauro M., Casalini S., Berto M., Campana A., Cramer T., Murgia M., Geoghegan M., Bortolotti C., Biscarini F.; ACS Applied Materials and Interfaces (8); 31783-31790 (2016) 10.1021/acsami.6b06952

Cooperativity at the glass transition: A perspective from facilitation on the analysis of relaxation in modulated calorimetry; Tombari E., Pieruccini M.; Physical Review E (94); 052504 (2016) 10.1103/PhysRevE.94.052504

Synthesis of Graphene Nanoribbons by Ambient-Pressure Chemical Vapor Deposition and Device Integration; Chen Z., Zhang W., Palma C.A., Lodi Rizzini A., Liu B., Abbas A., Richter N., Martini L., Wang X.Y., Cavani N., Lu H., Mishra N., Coletti C., Berger R., Klappenberger F., Kläui M., Candini A., Affronte M., Zhou C., De Renzi V., Del Pennino U., Barth J.V., Räder H.J., Narita A., Feng X., Müllen K.; Journal of the American Chemical Society (138); 15488-15496 (2016) 10.1021/jacs.6b10374

Tracking the coherent generation of polaron pairs in conjugated polymers; De Sio A., Troiani F., Maiuri M., Réhault J., Sommer E., Lim J., Huelga S.F., Plenio M.B., Rozzi C.A., Cerullo G., Molinari E., Lienau C.; Nature Communications (7); 13742 (2016) 10.1038/ncomms13742

Role of Electron Correlation along the Water Splitting Reaction; Chu S., Coccia E., Barborini M., Guidoni L.; Journal of Chemical Theory and Computation (12); 5803-5810 (2016) 10.1021/acs.jctc.6b00632

Experimental realization of the Ehrenberg-Siday thought experiment; Pozzi G., Boothroyd C.B., Tavabi A.H., Yücelen E., Dunin-Borkowski R.E., Frabboni S., Gazzadi G.C.; Applied Physics Letters (108); 083108 (2016) 10.1063/1.4942462

Coherent ultrafast polaron pair formation in a conjugated polymer at room temperature; De Sio A., Sommer E., Troiani F., Rehault J., Maiuri M., Molinari E., Cerullo G., Lienau C.; 2016 Conference on Lasers and Electro-Optics, CLEO 2016 7787953 (2016) 10.1364/cleo_qels.2016.fw4n.2

Whole organic electronic synapses for dopamine detection; Giordani M., Di Lauro M., Berto M., Bortolotti C.A., Vuillaume D., Gomes H.L., Zoli M., Biscarini F.; Proceedings of SPIE - The International Society for Optical Engineering (9944); 99440P (2016) 10.1117/12.2239532

Coherent vibronic coupling in a conjugated polymer at room temperature; De Sio A., Sommer E., Troiani F., Maiuri M., Rehault J., Lim J., Huelga S.F., Plenio M.B., Molinari E., Cerullo G., Lienau C.; Optics InfoBase Conference Papers (2016) 10.1364/UP.2016.UW3A.5

Real-Time description of the electronic dynamics for a molecule close to a plasmonic nanoparticle; Pipolo S., Corni S.; Journal of Physical Chemistry C (120); (2016) 10.1021/acs.jpcc.6b11084

Optical read-out of single carrier spin in semiconductor quantum dots; Troiani F., Wilson-Rae I., Tejedor C.; Semiconductor Quantum Bits 167-177 (2016) 10.4032/9789814241199

EC-STM/STS of redox metalloproteins and co-factors; Alessandrini A., Facci P.; Molecular Electronics: An Experimental and Theoretical Approach 325-252 (2016)

Simulation tools in molecular electronics; Erlen C., Lugli P., Pecchia A., Di Carlo A.; Nano and Molecular Electronics Handbook 19.1-19.20 (2016)

Metalloprotein electronics; Alessandrini A., Facci P.; Nano and Molecular Electronics Handbook 14.1-14.47 (2016)

Coherent ultrafast polaron pair formation in a conjugated polymer at room temperature; De Sio A., Sommer E., Troiani F., Rehault J., Maiuri M., Molinari E., Cerullo G., Lienau C.; Optics InfoBase Conference Papers FW4N.2 (2016)

Coherent vibronic coupling in a conjugated polymer at room temperature; De Sio A., Sommer E., Troiani F., Maiuri M., Rehault J., Lim J., Huelga S.F., Plenio M.B., Molinari E., Cerullo G., Lienau C.; Optics InfoBase Conference Papers (2016) 10.1364/UP.2016.UW3A.5

Optical properties of anthocyanins in the gas phase; Ge X., Calzolari A., Baroni S.; Chemical Physics Letters (618); 24-29 (2015) 10.1016/j.cplett.2014.09.025

Influence of Grain Size on the Thermoelectric Properties of Polycrystalline Silicon Nanowires; Suriano F., Ferri M., Moscatelli F., Mancarella F., Belsito L., Solmi S., Roncaglia A., Frabboni S., Gazzadi G.C., Narducci D.; Journal of Electronic Materials (44); 371-376 (2015) 10.1007/s11664-014-3207-1

Nanoscale frictional behavior of graphene on SiO2and Ni(111) substrates; Paolicelli G., Tripathi M., Corradini V., Candini A., Valeri S.; Nanotechnology (26); 055703 (2015) 10.1088/0957-4484/26/5/055703

Air-stable, non-volatile resistive memory based on hybrid organic/inorganic nanocomposites; Casula G., Cosseddu P., Busby Y., Pireaux J.J., Rosowski M., Tkacz Szczesna B., Soliwoda K., Celichowski G., Grobelny J., Novák J., Banerjee R., Schreiber F., Bonfiglio A.; Organic Electronics (18); 17-23 (2015) 10.1016/j.orgel.2015.01.001

Spin dynamics in hybrid iron oxide-gold nanostructures; Orlando T., Capozzi A., Umut E., Bordonali L., Mariani M., Galinetto P., Pineider F., Innocenti C., Masala P., Tabak F., Scavini M., Santini P., Corti M., Sangregorio C., Ghigna P., Lascialfari A.; Journal of Physical Chemistry C (119); 1224-1233 (2015) 10.1021/jp509411v

Holographic generation of highly twisted electron beams; Grillo V., Gazzadi G., Mafakheri E., Frabboni S., Karimi E., Boyd R.; Physical Review Letters (114); 034801 (2015) 10.1103/PhysRevLett.114.034801

Near-Field Optical Detection of Plasmon Resonance from Gold Nanoparticles: Theoretical and Experimental Evidence; Triolo C., Cacciola A., Saija R., Trusso S., Spadaro M.C., Neri F., Ossi P.M., Patanè S.; Plasmonics (10); 63-70 (2015) 10.1007/s11468-014-9778-0

Surface-assisted reactions toward formation of graphene nanoribbons on Au(110) surface; Massimi L., Ourdjini O., Lafferentz L., Koch M., Grill L., Cavaliere E., Gavioli L., Cardoso C., Prezzi D., Molinari E., Ferretti A., Mariani C., Betti M.G.; Journal of Physical Chemistry C (119); 2427-2437 (2015) 10.1021/jp509415r

On the role of the ablated mass on the propagation of a laser-generated plasma in an ambient gas; Spadaro M.C., Fazio E., Neri F., Trusso S., Ossi P.M.; EPL (109); 25002 (2015) 10.1209/0295-5075/109/25002

Morphology, structural properties and reducibility of size-selected CeO2-x nanoparticle films; Spadaro M., D'Addato S., Gasperi G., Benedetti F., Luches P., Grillo V., Bertoni G., Valeri S.; Beilstein Journal of Nanotechnology (6); 60-67 (2015) 10.3762/bjnano.6.7

Influence of size, shape and core-shell interface on surface plasmon resonance in Ag and Ag@MgO nanoparticle films deposited on Si/SiOx; D'Addato S., Pinotti D., Spadaro M.C., Paolicelli G., Grillo V., Valeri S., Pasquali L., Bergamini L., Corni S.; Beilstein Journal of Nanotechnology (6); 404-413 (2015) 10.3762/bjnano.6.40

Space- and time-dependent quantum dynamics of spatially indirect excitons in semiconductor heterostructures; Grasselli F., Bertoni A., Goldoni G.; Journal of Chemical Physics (142); 034701 (2015) 10.1063/1.4905483

Topological invariants in interacting quantum spin Hall: A cluster perturbation theory approach; Grandi F., Manghi F., Corradini O., Bertoni C.M., Bonini A.; New Journal of Physics (17); 023004 (2015) 10.1088/1367-2630/17/2/023004

Topological properties of the bond-modulated honeycomb lattice; Grandi F., Manghi F., Corradini O., Bertoni C.M.; Physical Review B - Condensed Matter and Materials Physics (91); 115112 (2015) 10.1103/PhysRevB.91.115112

Evidence of catalase mimetic activity in Ce³⁺/Ce⁴⁺ doped bioactive glasses; Nicolini V., Gambuzzi E., Malavasi G., Menabue L., Menziani M., Lusvardi G., Pedone A., Benedetti F., Luches P., D'Addato S., Valeri S.; Journal of Physical Chemistry B (119); 4009-4019 (2015) 10.1021/jp511737b

Origin of the accumulation layer at the InN/a-In2O3 interface; Aliano A., Cicero G., Catellani A.; ACS Applied Materials and Interfaces (7); 5415-5419 (2015) 10.1021/am508944s

Elastic and inelastic electrons in the double-slit experiment: A variant of Feynman's which-way set-up; Frabboni S., Gazzadi G., Grillo V., Pozzi G.; Ultramicroscopy (154); 49-56 (2015) 10.1016/j.ultramic.2015.03.006

Can azobenzene photoisomerize when chemisorbed on a gold surface? An analysis of steric effects based on nonadiabatic dynamics simulations; Benassi E., Granucci G., Persico M., Corni S.; Journal of Physical Chemistry C (119); 5962-5974 (2015) 10.1021/jp511269p

Analytical expression of genuine tripartite quantum discord for symmetrical X-states; Beggi A., Buscemi F., Bordone P.; Quantum Information Processing (14); 573-592 (2015) 10.1007/s11128-014-0882-z

Effect of neurosteroids on a model lipid bilayer including cholesterol: An Atomic Force Microscopy study; Sacchi M., Balleza D., Vena G., Puia G., Facci P., Alessandrini A.; Biochimica et Biophysica Acta - Biomembranes (1848); 1258-1267 (2015) 10.1016/j.bbamem.2015.01.002

Effects of neurosteroids on a model membrane including cholesterol: A micropipette aspiration study; Balleza D., Sacchi M., Vena G., Galloni D., Puia G., Facci P., Alessandrini A.; Biochimica et Biophysica Acta - Biomembranes (1848); 1268-1276 (2015) 10.1016/j.bbamem.2015.01.017

Probing the influence of citrate-capped gold nanoparticles on an amyloidogenic protein; Brancolini G., Corazza A., Vuano M., Fogolari F., Mimmi M.C., Bellotti V., Stoppini M., Corni S., Esposito G.; ACS Nano (9); 2600-2613 (2015) 10.1021/nn506161j

Electroburning of few-layer graphene flakes, epitaxial graphene, and turbostratic graphene discs in air and under vacuum; Candini A., Richter N., Convertino D., Coletti C., Balestro F., Wernsdorfer W., Kläui M., Affronte M.; Beilstein Journal of Nanotechnology (6); 711-719 (2015) 10.3762/bjnano.6.72

Charge Separation Dynamics and Opto-Electronic Properties of a Diaminoterephthalate-C60 Dyad; Pittalis S., Delgado A., Robin J., Freimuth L., Christoffers J., Lienau C., Rozzi C.; Advanced Functional Materials (25); 2047-2053 (2015) 10.1002/adfm.201402316

Aharonov-Bohm oscillations and electron gas transitions in hexagonal core-shell nanowires with an axial magnetic field; Royo M., Segarra C., Bertoni A., Goldoni G., Planelles J.; Physical Review B - Condensed Matter and Materials Physics (91); 115440 (2015) 10.1103/PhysRevB.91.115440

Observation of different charge transport regimes and large magnetoresistance in graphene oxide layers; Vianelli A., Candini A., Treossi E., Palermo V., Affronte M.; Carbon (89); 188-196 (2015) 10.1016/j.carbon.2015.03.019

Accurate and inexpensive prediction of the color optical properties of anthocyanins in solution; Ge X., Timrov I., Binnie S., Biancardi A., Calzolari A., Baroni S.; Journal of Physical Chemistry A (119); 3816-3822 (2015) 10.1021/acs.jpca.5b01272

Enhancing participation to health screening campaigns by group interactions; Burioni R., Contucci P., Fedele M., Vernia C., Vezzani A.; Scientific Reports (5); 9904 (2015) 10.1038/srep09904

Pairing of a few Fermi atoms in one dimension; D'Amico P., Rontani M.; Physical Review A - Atomic, Molecular, and Optical Physics (91); 043610 (2015) 10.1103/PhysRevA.91.043610

Variational minimization of orbital-density-dependent functionals; Borghi G., Park C.H., Nguyen N.L., Ferretti A., Marzari N.; Physical Review B - Condensed Matter and Materials Physics (91); 155112 (2015) 10.1103/PhysRevB.91.155112

YBa2Cu3O7 microwave resonators for strong collective coupling with spin ensembles; Ghirri A., Bonizzoni C., Gerace D., Sanna S., Cassinese A., Affronte M.; Applied Physics Letters (106); 184101 (2015) 10.1063/1.4920930

First-principles photoemission spectroscopy and orbital tomography in molecules from koopmans-compliant functionals; Nguyen N., Borghi G., Ferretti A., Dabo I., Marzari N.; Physical Review Letters (114); 166405 (2015) 10.1103/PhysRevLett.114.166405

Unconventional co-existence of plasmon and thermoelectric activity in In:ZnO nanowires; Catellani A., Ruini A., Nardelli M., Calzolari A.; RSC Advances (5); 44865-44872 (2015) 10.1039/c5ra06199g

Method for estimating the cooperativity length in polymers; Pieruccini M., Alessandrini A.; Physical Review E - Statistical, Nonlinear, and Soft Matter Physics (91); 052603 (2015) 10.1103/PhysRevE.91.052603

Looking inside the perchlorinated trityl radical/metal spinterface through spectroscopy; Mugnaini V., Calzolari A., Ovsyannikov R., Vollmer A., Gonidec M., Alcon I., Veciana J., Pedio M.; Journal of Physical Chemistry Letters (6); 2101-2106 (2015) 10.1021/acs.jpclett.5b00848

Equation of motion for the solvent polarization apparent charges in the polarizable continuum model: Application to real-time TDDFT; Corni S., Pipolo S., Cammi R.; Journal of Physical Chemistry A (119); 5405-5416 (2015) 10.1021/jp5106828

Tribochemistry of phosphorus additives: Experiments and first-principles calculations; De Barros-Bouchet M., Righi M., Philippon D., Mambingo-Doumbe S., Le-Mogne T., Martin J., Bouffet A.; RSC Advances (5); 49270-49279 (2015) 10.1039/c5ra00721f

Prediction of inelastic light scattering spectra from electronic collective excitations in GaAs/AlGaAs core-multishell nanowires; Royo M., Bertoni A., Goldoni G.; Physical Review B - Condensed Matter and Materials Physics (91); 245303 (2015) 10.1103/PhysRevB.91.245303

Quasiparticle spectrum and plasmonic excitations in the topological insulator Sb2Te3; Nechaev I.A., Aguilera I., De Renzi V., Di Bona A., Lodi Rizzini A., Mio A.M., Nicotra G., Politano A., Scalese S., Aliev Z.S., Babanly M.B., Friedrich C., Blügel S., Chulkov E.V.; Physical Review B - Condensed Matter and Materials Physics (91); 245123 (2015) 10.1103/PhysRevB.91.245123

Microstrip Resonators and Broadband Lines for X-band EPR Spectroscopy of Molecular Nanomagnets; Ghirri A., Bonizzoni C., Righi M., Fedele F., Timco G., Winpenny R., Affronte M.; Applied Magnetic Resonance (46); 749-756 (2015) 10.1007/s00723-015-0672-5

Structural transitions in electron beam deposited Co-carbonyl suspended nanowires at high electrical current densities; Gazzadi G., Frabboni S.; Beilstein Journal of Nanotechnology (6); 1298-1305 (2015) 10.3762/bjnano.6.134

ZnO nanostructure formation on the Mo(001) surface; Valenti I., Benedetti S., Di Bona A., Valeri S.; Journal of Physical Chemistry C (119); 13743-13749 (2015) 10.1021/acs.jpcc.5b03391

Probing coherent ultrafast exciton dissociation in a polymer: Fullerene photovoltaic absorber; De Sio A., Sommer E., Maiuri M., Rehault J., Rozzi C.A., Molinari E., Cerullo G., Lienau C.; CLEO: QELS - Fundamental Science, CLEO_QELS 2015 1551p (2015) 10.1364/CLEO_QELS.2015.FM2B.4

Human Neuronal SHSY5Y Cells on PVDF:PTrFE Copolymer Thin Films; Tonazzini I., Bystrenova E., Chelli B., Greco P., De Leeuw D., Biscarini F.; Advanced Engineering Materials (17); 1051-1056 (2015) 10.1002/adem.201400441

InAs/GaAs Sharply Defined Axial Heterostructures in Self-Assisted Nanowires; Scarpellini D., Somaschini C., Fedorov A., Bietti S., Frigeri C., Grillo V., Esposito L., Salvalaglio M., Marzegalli A., Montalenti F., Bonera E., Medaglia P.G., Sanguinetti S.; Nano Letters (15); 3677-3683 (2015) 10.1021/nl504690r

Single-Molecule Folding Mechanisms of the apo- and Mg²⁺-Bound States of Human Neuronal Calcium Sensor-1; Naqvi M.M., Heidarsson P.O., Otazo M.R., Mossa A., Kragelund B.B., Cecconi C.; Biophysical Journal (109); 113-123 6590 (2015) 10.1016/j.bpj.2015.05.028

Phase ordering in disordered and inhomogeneous systems; Corberi F., Zannetti M., Lippiello E., Burioni R., Vezzani A.; Physical Review E - Statistical, Nonlinear, and Soft Matter Physics (91); 062122 (2015) 10.1103/PhysRevE.91.062122

Spectrum of noncollinear metastable configurations of a finite-size discrete planar spin chain with a collinear ferromagnetic ground state; Popov A.P., Rettori A., Pini M.G.; Physical Review B - Condensed Matter and Materials Physics (92); 024414 (2015) 10.1103/PhysRevB.92.024414

Structured quantum waves; Harris J., Grillo V., Mafakheri E., Gazzadi G., Frabboni S., Boyd R., Karimi E.; Nature Physics (11); 629-634 (2015) 10.1038/nphys3404

Optoelectronic properties and color chemistry of native point defects in Al:ZnO transparent conductive oxide; Catellani A., Ruini A., Calzolari A.; Journal of Materials Chemistry C (3); 8419-8424 (2015) 10.1039/c5tc01699a

Frictional transition from superlubric islands to pinned monolayers; Pierno M., Bruschi L., Mistura G., Paolicelli G., Di Bona A., Valeri S., Guerra R., Vanossi A., Tosatti E.; Nature Nanotechnology (10); 714-718 (2015) 10.1038/nnano.2015.106

Effects of the Dzyaloshinskii-Moriya interaction in Cr3 triangular spin clusters detected by specific heat and multi-frequency electron spin resonance; Ghirri A., Van Tol J., Vitorica-Yrezabal I., Timco G.A., Winpenny R.E.P.; Dalton Transactions (44); 14027-14033 (2015) 10.1039/c5dt01938a

Non-linear optical response by functionalized gold nanospheres: identifying design principles to maximize the molecular photo-release; Bergamini L., Voliani V., Cappello V., Nifosì R., Corni S.; Nanoscale (7); 13345-13357 (2015) 10.1039/c5nr03037d

Facet selectivity in gold binding peptides: exploiting interfacial water structure; Wright L.B., Palafox-Hernandez J.P., Rodger P.M., Corni S., Walsh T.R.; Chemical Science (6); 5204-5214 (2015) 10.1039/c5sc00399g

Thermodynamics and kinetics of reduction and species conversion at a hydrophobic surface for mitochondrial cytochromes c and their cardiolipin adducts; Ranieri A., Di Rocco G., Millo D., Battistuzzi G., Bortolotti C.A., Lancellotti L., Borsari M., Sola M.; Electrochimica Acta (176); 1019-1028 25347 (2015) 10.1016/j.electacta.2015.07.065

Affinity and Selectivity of Peptides for Inorganic Materials: A Thermodynamic Discussion of the Role of Conformational Flexibility; Corni S.; JOM (67); 781-787 (2015) 10.1007/s11837-015-1334-7

Surface Immobilized His-tagged Azurin as a Model Interface for the Investigation of Vectorial Electron Transfer in Biological Systems; Casalini S., Berto M., Kovtun A., Operamolla A., Di Rocco G., Facci P., Liscio A., Farinola G., Borsari M., Bortolotti C.; Electrochimica Acta (178); 638-646 25438 (2015) 10.1016/j.electacta.2015.07.156

Immobilized cytochrome c bound to cardiolipin exhibits peculiar oxidation state-dependent axial heme ligation and catalytically reduces dioxygen; Ranieri A., Millo D., Di Rocco G., Battistuzzi G., Bortolotti C., Borsari M., Sola M.; Journal of Biological Inorganic Chemistry (20); 531-540 1238 (2015) 10.1007/s00775-015-1238-6

A diaminoterephthalate-C60 dyad: A new material for optoelectronic applications; Freimuth L., Rozzi C.A., Lienau C., Christoffers J.; Synthesis (Germany) (47); 1325-1328 ss-2014-t0694-op (2015) 10.1055/s-0034-1379963

Strain-designed strategy to induce and enhance second-harmonic generation in centrosymmetric and noncentrosymmetric materials; Luppi E., Degoli E., Bertocchi M., Ossicini S., Véniard V.; Physical Review B - Condensed Matter and Materials Physics (92); 075204 (2015) 10.1103/PhysRevB.92.075204

Pyramid-Shaped Wurtzite CdSe Nanocrystals with Inverted Polarity; Ghosh S., Gaspari R., Bertoni G., Spadaro M., Prato M., Turner S., Cavalli A., Manna L., Brescia R.; ACS Nano (9); 8537-8546 (2015) 10.1021/acsnano.5b03636

Almost exact exchange at almost no computational cost in electronic structure; Elliott P., Cangi A., Pittalis S., Gross E., Burke K.; Physical Review A - Atomic, Molecular, and Optical Physics (92); 022513 (2015) 10.1103/PhysRevA.92.022513

First-principles comparative study on the interlayer adhesion and shear strength of transition-metal dichalcogenides and graphene; Levita G., Molinari E., Polcar T., Righi M.; Physical Review B - Condensed Matter and Materials Physics (92); 085434 (2015) 10.1103/PhysRevB.92.085434

Optical properties of single wurtzite/zinc-blende ZnSe nanowires grown at low temperature; Zannier V., Cremel T., Artioli A., Ferrand D., Kheng K., Grillo V., Rubini S.; Journal of Applied Physics (118); 095702 (2015) 10.1063/1.4929821

Distance-based configurational entropy of proteins from molecular dynamics simulations; Fogolari F., Corazza A., Fortuna S., Soler M.A., Van Schouwen B., Brancolini G., Corni S., Melacini G., Esposito G.; PLoS ONE (10); e0132356 (2015) 10.1371/journal.pone.0132356

The dissipative Bose-Hubbard model: Methods and examples; Kordas G., Witthaut D., Buonsante P., Vezzani A., Burioni R., Karanikas A.I., Wimberger S.; European Physical Journal: Special Topics (224); 2127-2171 (2015) 10.1140/epjst/e2015-02528-2

Conservation analysis of residues in the S4–S5 linker and the terminal part of the S5-P-S6 pore modulus in Kv and HCN channels: flexible determinants for the electromechanical coupling; Balleza D., Carrillo E., Gómez-Lagunas F.; Pflugers Archiv European Journal of Physiology (467); 2069-2079 (2015) 10.1007/s00424-014-1647-3

The role of polarization-induced reorientation of DNA strands on organic field-effect transistor-based biosensors sensitivity at high ionic strength; Lai S., Barbaro M., Bonfiglio A.; Applied Physics Letters (107); 103301 (2015) 10.1063/1.4930303

Steering random walks with kicked ultracold atoms; Weiß M., Groiseau C., Lam W.K., Burioni R., Vezzani A., Summy G.S., Wimberger S.; Physical Review A - Atomic, Molecular, and Optical Physics (92); 033606 (2015) 10.1103/PhysRevA.92.033606

Quasiparticle band structure; Manghi F., Boni V.; Journal of Electron Spectroscopy and Related Phenomena (200); 181-192 (2015) 10.1016/j.elspec.2015.05.008

Ferromagnetic shape memory thin films and nanodisks: Tuning properties by thickness, lattice mismatch and lateral confinement; Albertini F., Ranzieri P., Campanini M., Chiesi V., Fabbrici S., Casoli F., Nasi L., Righi L., Grillo V., Celegato F., Tiberto P., Barrera G.; 2015 IEEE International Magnetics Conference, INTERMAG 2015 7157270 (2015) 10.1109/INTMAG.2015.7157270

Magnetic interplay between two different lanthanides in a tris-phthalocyaninato complex: a viable synthetic route and detailed investigation in the bulk and on the surface; Lan Y., Klyatskaya S., Ruben M., Fuhr O., Wernsdorfer W., Candini A., Corradini V., Lodi Rizzini A., Del Pennino U., Troiani F., Joly L., Klar D., Wende H., Affronte M.; Journal of Materials Chemistry C (3); 9794-9801 (2015) 10.1039/c5tc02011e

Small and large scale segmental motion in polymers: Estimating cooperativity length by ordinary relaxation experiments; Pieruccini M., Alessandrini A., Sturniolo S., Corti M., Rigamonti A.; Polymer International (64); 1506-1512 (2015) 10.1002/pi.4894

Quantum description of the matter-radiation interaction; Maria C.; Synchrotron Radiation: Basics, Methods and Applications 145-178 (2015) 10.1007/978-3-642-55315-8_5

Modeling solvation effects in real-space and real-time within density functional approaches; Delgado A., Corni S., Pittalis S., Rozzi C.; Journal of Chemical Physics (143); 144111 (2015) 10.1063/1.4932593

Tuning Electron Transport through Functionalized C20H10 Molecular Junctions; Zoppi L., Ferretti A., Baldridge K.; Journal of Chemical Theory and Computation (11); 4900-4910 (2015) 10.1021/acs.jctc.5b00592

Single-Molecule Magnetism, Enhanced Magnetocaloric Effect, and Toroidal Magnetic Moments in a Family of Ln4 Squares; Das C., Vaidya S., Gupta T., Frost J.M., Righi M., Brechin E.K., Affronte M., Rajaraman G., Shanmugam M.; Chemistry - A European Journal (21); 15639-15650 (2015) 10.1002/chem.201502720

A novel analysis for the NMR magic sandwich echo in polymers: application to the α-relaxation in polybutadiene; Pieruccini M., Sturniolo S., Corti M., Rigamonti A.; European Physical Journal B (88); 1-7 283 (2015) 10.1140/epjb/e2015-60417-6

Electrical, optical, and electronic properties of Al:ZnO films in a wide doping range; Valenti I., Benedetti S., Di Bona A., Lollobrigida V., Perucchi A., Di Pietro P., Lupi S., Valeri S., Torelli P.; Journal of Applied Physics (118); 165304 (2015) 10.1063/1.4934512

Nanostructured P3HT layers fabricated by self-assembly as promising gas sensors; Viviani E., Zilio S., Bertoni C., Fraleoni-Morgera A.; 2015 11th Conference on Ph.D. Research in Microelectronics and Electronics, PRIME 2015 385-388 7251416 (2015) 10.1109/PRIME.2015.7251416

Chromium-Doped MgO Thin Films: Morphology, Electronic Structure, and Segregation Effects; Benedetti S., Nilius N., Valeri S.; Journal of Physical Chemistry C (119); 25469-25475 (2015) 10.1021/acs.jpcc.5b09033

A few key residues determine the high redox potential shift in azurin mutants; Zanetti-Polzi L., Bortolotti C., Daidone I., Aschi M., Amadei A., Corni S.; Organic and Biomolecular Chemistry (13); 11003-11013 (2015) 10.1039/c5ob01819f

Tunability of exchange bias in Ni@NiO core-shell nanoparticles obtained by sequential layer deposition; Spadaro M.C., D'Addato S., Luches P., Valeri S., Grillo V., Rotunno E., Roldan M.A., Pennycook S.J., Ferretti A.M., Capetti E., Ponti A.; Nanotechnology (26); 405704 (2015) 10.1088/0957-4484/26/40/405704

Time-dependent simulation and analytical modelling of electronic Mach-Zehnder interferometry with edge-states wave packets; Beggi A., Bordone P., Buscemi F., Bertoni A.; Journal of Physics Condensed Matter (27); 475301 (2015) 10.1088/0953-8984/27/47/475301

Comparison of spin dynamics and magnetic properties in antiferromagnetic closed and open molecular Cr-based rings; Adelnia F., Bordonali L., Mariani M., Bordignon S., Timco G., Winpenny R., Borsa F., Lascialfari A.; Journal of Physics Condensed Matter (27); 506001 (2015) 10.1088/0953-8984/27/50/506001

Trimethyl-phosphite dissociative adsorption on iron by combined first-principle calculations and XPS experiments; Righi M.C., Loehlé S., De Barros Bouchet M.I., Philippon D., Martin J.M.; RSC Advances (5); 101162-101168 (2015) 10.1039/c5ra14446a

Resonating Behaviour of Nanomachined Holed Microcantilevers; Canavese G., Ricci A., Gazzadi G., Ferrante I., Mura A., Marasso S., Ricciardi C.; Scientific Reports (5); 17837 (2015) 10.1038/srep17837

Investigating Disjoint Non-Kekulé Diradicals with Quantum Monte Carlo: The Tetramethyleneethane Molecule through the Jastrow Antisymmetrized Geminal Power Wave Function; Barborini M., Coccia E.; Journal of Chemical Theory and Computation (11); 5696-5704 (2015) 10.1021/acs.jctc.5b00819

In-plane rotation of magnetic stripe domains in Fe1-xGax thin films; Fin S., Tomasello R., Bisero D., Marangolo M., Sacchi M., Popescu H., Eddrief M., Hepburn C., Finocchio G., Carpentieri M., Rettori A., Pini M.G., Tacchi S.; Physical Review B - Condensed Matter and Materials Physics (92); 224411 (2015) 10.1103/PhysRevB.92.224411

Turning an organic semiconductor into a low-resistance material by ion implantation; Fraboni B., Scidà A., Cosseddu P., Wang Y., Nastasi M., Milita S., Bonfiglio A.; Science and Technology of Advanced Materials (16); 065008 (2015) 10.1088/1468-6996/16/6/065008

Electronic Structure of a Mixed-Metal Fluoride-Centered Triangle Complex: A Potential Qubit Component; Walsh J.P.S., Meadows S.B., Ghirri A., Moro F., Jennings M., Smith W.F., Graham D.M., Kihara T., Nojiri H., Vitorica-Yrezabal I.J., Timco G.A., Collison D., McInnes E.J.L., Winpenny R.E.P.; Inorganic Chemistry (54); 12019-12026 (2015) 10.1021/acs.inorgchem.5b01898

Coherent Spin Dynamics in Molecular Cr8Zn Wheels; Ghirri A., Chiesa A., Carretta S., Troiani F., Van Tol J., Hill S., Vitorica-Yrezabal I., Timco G.A., Winpenny R.E.P., Affronte M.; Journal of Physical Chemistry Letters (6); 5062-5066 (2015) 10.1021/acs.jpclett.5b02527

Solvent tunes the peroxidase activity of cytochrome c immobilized on kaolinite; Castellini E., Bernini F., Berto M., Borsari M., Sola M., Ranieri A.; Applied Clay Science (118); 316-324 (2015) 10.1016/j.clay.2015.10.012

Time-Dependent Modelling of Single-Electron Interferometry with Edge-States; Beggi A., Bertoni A., Bordone P.; Journal of Physics: Conference Series (647); 012023 (2015) 10.1088/1742-6596/647/1/012023

Organic FET-based DNA hybridization sensor with sub-picomolar sensitivity; Lai S., Barbaro M., Bonfiglio A.; Proceedings of the Annual International Conference of the IEEE Engineering in Medicine and Biology Society, EMBS (2015-November); 7958-7961 7320238 (2015) 10.1109/EMBC.2015.7320238

Low temperature magnetic properties and spin dynamics in single crystals of Cr8Zn antiferromagnetic molecular rings; Adelnia F., Chiesa A., Bordignon S., Carretta S., Ghirri A., Candini A., Cervetti C., Evangelisti M., Affronte M., Sheikin I., Winpenny R., Timco G., Borsa F., Lascialfari A.; Journal of Chemical Physics (143); 244321 (2015) 10.1063/1.4938086

Protein-based transistors; Alessandrini A., Facci P.; Handbook of Bioelectronics: Directly Interfacing Electronics and Biological Systems 49-65 (2015) 10.1017/CBO9781139629539.006

Tuning electrical properties of hierarchically assembled Al-doped ZnO nanoforests by room temperature Pulsed Laser Deposition; Gondoni P., Mazzolini P., Russo V., Diani M., Amati M., Gregoratti L., De Renzi V., Gazzadi G.C., Martí-Rujas J., Li Bassi A., Casari C.S.; Thin Solid Films (594); 12-17 (2015) 10.1016/j.tsf.2015.09.066

Coherent ultrafast charge transfer in an organic photovoltaic blend; Sio A.D., Falke S.M., Rozzi C.A., Brida D., Maiuri M., Amato M., Sommer E., Rubio A., Cerullo G., Molinari E., Lienau C.; Springer Proceedings in Physics (162); 557-560 (2015) 10.1007/978-3-319-13242-6_136

Highly flexible and low voltage Organic Thin Film Transistors for wearable electronics and e-skin applications; Cosseddu P., Lai S., Bonfiglio A.; IEEE-NANO 2015 - 15th International Conference on Nanotechnology 1317-1319 7388876 (2015) 10.1109/NANO.2015.7388876

The long road to the use of microscope in clinical medicine in vivo: From early pioneering proposals to the modern perspectives of optical biopsy; Ponti G., Muscatello U.; AMHA - Acta Medico-Historica Adriatica (13); 385-392 (2015)

Microscale study of frictional properties of graphene in ultra high vacuum; Marchetto D., Feser T., Dienwiebel M.; Friction (3); 161-169 (2015) 10.1007/s40544-015-0080-8

Integration of an Organic Resistive Memory with a Pressure-Sensitive Element on a Fully Flexible Substrate; Casula G., Cosseddu P., Bonfiglio A.; Advanced Electronic Materials (1); 1500234 (2015) 10.1002/aelm.201500234

Pressure-Triggered Memory: Integration of an Organic Resistive Memory with a Pressure-Sensitive Element on a Fully Flexible Substrate (Adv. Electron. Mater. 12/2015); Casula G., Cosseddu P., Bonfiglio A.; Advanced Electronic Materials (1); AELM201570048 (2015) 10.1002/aelm.201570048

Exploiting bacterial pathways for BBB crossing with PLGA nanoparticles modified with a mutated form of diphtheria toxin (CRM197): In vivo experiments; Tosi G., Vilella A., Veratti P., Belletti D., Pederzoli F., Ruozi B., Vandelli M.A., Zoli M., Forni F.; Molecular Pharmaceutics (12); 3672-3684 (2015) 10.1021/acs.molpharmaceut.5b00446

An Orbital Angular Momentum Spectrometer for Electrons; Harvey T., Grillo V., McMorran B.; Microscopy and Microanalysis (21); 23-24 (2015) 10.1017/S1431927615000914

Quantum Computation with Molecular Nanomagnets: Achievements, Challenges, and New Trends; Ghirri A., Troiani F., Affronte M.; Structure and Bonding (164); 383-430 (2015) 10.1007/430_2014_145

Solid State Organic X-Ray Detectors Based on Rubrene Single Crystals; Basirico L., Ciavatti A., Sibilia M., Fraleoni-Morgera A., Trabattoni S., Sassella A., Fraboni B.; IEEE Transactions on Nuclear Science (62); 1791-1797 7181744 (2015) 10.1109/TNS.2015.2456418

Bandgap renormalization governs the ultrafast response of single-layer MoS2; Pogna E.A.A., Dal Conte S., Marsili M., Prezzi D., Sangalli D., Manzoni C., Marini A., De Fazio D., Bruna M., Goykhman I., Ferrari A.C., Cerullo G.; Proceedings 2015 European Conference on Lasers and Electro-Optics - European Quantum Electronics Conference, CLEO/Europe-EQEC 2015 (2015)

Probing coherent ultrafast exciton dissociation in a polymer: Fullerene photovoltaic absorber; De Sio A., Sommer E., Maiuri M., Rehault J., Rozzi C.A., Molinari E., Cerullo G., Lienau C.; Conference on Lasers and Electro-Optics Europe - Technical Digest (2015-August); 7183070 (2015)

Bandgap renormalization governs the ultrafast response of single-layer MoS2; Pogna E.A.A., Dal Conte S., Marsili M., Prezzi D., Sangalli D., Manzoni C., Marini A., De Fazio D., Bruna M., Goykhman I., Ferrari A.C., Cerullo G.; Optics InfoBase Conference Papers (2015)

Bandgap renormalization governs the ultrafast response of single-layer MoS2; Pogna E.A.A., Dal Conte S., Marsili M., Prezzi D., Sangalli D., Manzoni C., Marini A., De Fazio D., Bruna M., Goykhman I., Ferrari A.C., Cerullo G.; Optics InfoBase Conference Papers (2015)

Coherent ultrafast exciton dissociation in polymer: Fullerene thin films; De Sio A., Sommer E., Maiuri M., Rehault J., Rozzi C.A., Molinari E., Cerullo G., Lienau C.; Optics InfoBase Conference Papers (2015)

High stability and sensitivity of gold nano-islands for localized surface plasmon spectroscopy: Role of solvent viscosity and morphology; Longobucco G., Fasano G., Zharnikov M., Bergamini L., Corni S., Rampi M.; Sensors and Actuators, B: Chemical (191); 356-363 (2014) 10.1016/j.snb.2013.09.026

Synthesis and magnetothermal properties of a ferromagnetically coupled Ni^II-Gd^III-Ni^II cluster; Upadhyay A., Komatireddy N., Ghirri A., Tuna F., Langley S.K., Srivastava A.K., Sañudo E.C., Moubaraki B., Murray K.S., McInnes E.J.L., Affronte M., Shanmugam M.; Dalton Transactions (43); 259-266 (2014) 10.1039/c3dt52384e

Statistical properties and morphology of a 2D gel network at the air/water interface; Orsi D., Vezzani A., Burioni R., Pucci A., Ruggeri G., Cristofolini L.; Colloids and Surfaces A: Physicochemical and Engineering Aspects (441); 912-918 (2014) 10.1016/j.colsurfa.2013.04.020

Multi-orbital cluster perturbation theory for transition metal oxides; Manghi F.; Journal of Physics Condensed Matter (26); 015602 (2014) 10.1088/0953-8984/26/1/015602

Generation of a spin-polarized electron beam by multipole magnetic fields; Karimi E., Grillo V., Boyd R.W., Santamato E.; Ultramicroscopy (138); 22-27 (2014) 10.1016/j.ultramic.2013.12.002

Rotatable magnetic anisotropy in a Fe 0.8 Ga 0.2 thin film with stripe domains: Dynamics versus statics; Tacchi S., Fin S., Carlotti G., Gubbiotti G., Madami M., Barturen M., Marangolo M., Eddrief M., Bisero D., Rettori A., Pini M.G.; Physical Review B - Condensed Matter and Materials Physics (89); 024411 (2014) 10.1103/PhysRevB.89.024411

The absorption spectrum of C60 in n-hexane solution revisited: Fitted experiment and TDDFT/PCM calculations; Menéndez-Proupin E., Delgado A., Montero-Alejo A., García De La Vega J.; Chemical Physics Letters (593); 72-76 (2014) 10.1016/j.cplett.2013.12.067

Low temperature spin dynamics in Cr7Ni-Cu-Cr7Ni coupled molecular rings; Bordonali L., Furukawa Y., Mariani M., Sabareesh K.P.V., Garlatti E., Carretta S., Lascialfari A., Timco G., Winpenny R.E.P., Borsa F.; Journal of Applied Physics (115); 17E102 (2014) 10.1063/1.4853255

Silicon-germanium nanowires: Chemistry and physics in play, from basic principles to advanced applications; Amato M., Palummo M., Rurali R., Ossicini S.; Chemical Reviews (114); 1371-1412 (2014) 10.1021/cr400261y

Is the G-quadruplex an effective nanoconductor for ions?; Ngo V., Di Felice R., Haas S.; Journal of Physical Chemistry B (118); 864-872 (2014) 10.1021/jp408071h

Micromagnetic simulation of energy consumption and excited eigenmodes in elliptical nanomagnetic switches; Carlotti G., Madami M., Gubbiotti G., Tacchi S.; Physica B: Condensed Matter (435); 4-7 (2014) 10.1016/j.physb.2013.10.022

Ab initio geometry and bright excitation of carotenoids: Quantum monte carlo and many body green's function theory calculations on peridinin; Coccia E., Varsano D., Guidoni L.; Journal of Chemical Theory and Computation (10); 501-506 (2014) 10.1021/ct400943a

Strong blue emission from ZnSe nanowires grown at low temperature; Zannier V., Martelli F., Grillo V., Plaisier J., Lausi A., Rubini S.; Physica Status Solidi - Rapid Research Letters (8); 182-186 (2014) 10.1002/pssr.201308264

Wigner transport equation with finite coherence length; Jacoboni C., Bordone P.; Journal of Computational Electronics (13); 257-263 (2014) 10.1007/s10825-013-0510-7

Three interacting atoms in a one-dimensional trap: A benchmark system for computational approaches; D'Amico P., Rontani M.; Journal of Physics B: Atomic, Molecular and Optical Physics (47); 065303 (2014) 10.1088/0953-4075/47/6/065303

Average synaptic activity and neural networks topology: A global inverse problem; Burioni R., Casartelli M., Di Volo M., Livi R., Vezzani A.; Scientific Reports (4); 4336 (2014) 10.1038/srep04336

Nitrocatechol/ZnO interface: The role of dipole in a dye/metal-oxide model system; Arnaud G., De Renzi V., Del Pennino U., Biagi R., Corradini V., Calzolari A., Ruini A., Catellani A.; Journal of Physical Chemistry C (118); 3910-3917 (2014) 10.1021/jp410376r

Polarity-driven polytypic branching in Cu-based quaternary chalcogenide nanostructures; Zamani R.R., Ibáez M., Luysberg M., García-Castelló N., Houben L., Prades J.D., Grillo V., Dunin-Borkowski R.E., Morante J.R., Cabot A., Arbiol J.; ACS Nano (8); 2290-2301 (2014) 10.1021/nn405747h

Effect of motional restriction on the unfolding properties of a cytochrome c featuring a His/Met-His/His ligation switch; Ranieri A., Bortolotti C., Battistuzzi G., Borsari M., Paltrinieri L., Di Rocco G., Sola M.; Metallomics (6); 874-884 (2014) 10.1039/c3mt00311f

Superdiffusion and transport in two-dimensional systems with Lévy-like quenched disorder; Burioni R., Ubaldi E., Vezzani A.; Physical Review E - Statistical, Nonlinear, and Soft Matter Physics (89); 022135 (2014) 10.1103/PhysRevE.89.022135

Enthalpy-entropy tuning in the adsorption of nucleobases at the Au(111) surface; Rosa M., Corni S., Di Felice R.; Journal of Chemical Theory and Computation (10); 1707-1716 (2014) 10.1021/ct401117g

Wettability of azobenzene self-assembled monolayers; Pipolo S., Corni S.; Langmuir (30); 4415-4421 (2014) 10.1021/la404922f

Field-regulated switching of the magnetization of Co-porphyrin on graphene; Klar D., Bhandary S., Candini A., Joly L., Ohresser P., Klyatskaya S., Schleberger M., Ruben M., Affronte M., Eriksson O., Sanyal B., Wende H.; Physical Review B - Condensed Matter and Materials Physics (89); 144411 (2014) 10.1103/PhysRevB.89.144411

A practical approach for the detection of DNA nanostructures in single live human cells by fluorescence microscopy; Bergamini C., Angelini P., Rhoden K.J., Porcelli A.M., Fato R., Zuccheri G.; Methods (67); 185-192 (2014) 10.1016/j.ymeth.2014.01.009

Symmetries in the collective excitations of an electron gas in core-shell nanowires; Royo M., Bertoni A., Goldoni G.; Physical Review B - Condensed Matter and Materials Physics (89); 155416 (2014) 10.1103/PhysRevB.89.155416

How the reorganization free energy affects the reduction potential of structurally homologous cytochromes; Daidone I., Amadei A., Zaccanti F., Borsari M., Bortolotti C.; Journal of Physical Chemistry Letters (5); 1534-1540 (2014) 10.1021/jz5005208

Optical enhancement in heteroleptic Ru(II) polypyridyl complexes using electron-donor ancillary ligands; Dong R., Calzolari A., Di Felice R., El-Shafei A., Hussain M., Buongiorno Nardelli M.; Journal of Physical Chemistry C (118); 8747-8755 (2014) 10.1021/jp409733a

Generation of nondiffracting electron bessel beams; Grillo V., Karimi E., Gazzadi G., Frabboni S., Dennis M., Boyd R.; Physical Review X (4); 011013 (2014) 10.1103/PhysRevX.4.011013

Unintentional high-density p-type modulation doping of a GaAs/alas core-multishell nanowire; Jadczak J., Plochocka P., Mitioglu A., Breslavetz I., Royo M., Bertoni A., Goldoni G., Smolenski T., Kossacki P., Kretinin A., Shtrikman H., Maude D.K.; Nano Letters (14); 2807-2814 (2014) 10.1021/nl500818k

Construction of the B88 exchange-energy functional in two dimensions; Vilhena J.G., Räsänen E., Marques M.A.L., Pittalis S.; Journal of Chemical Theory and Computation (10); 1837-1842 (2014) 10.1021/ct4010728

Ab initio simulation of optical limiting: The case of metal-free phthalocyanine; Cocchi C., Prezzi D., Ruini A., Molinari E., Rozzi C.; Physical Review Letters (112); 198303 (2014) 10.1103/PhysRevLett.112.198303

Controlled growth of Ni/NiO core-shell nanoparticles: Structure, morphology and tuning of magnetic properties; D'Addato S., Spadaro M., Luches P., Grillo V., Frabboni S., Valeri S., Ferretti A., Capetti E., Ponti A.; Applied Surface Science (306); 2-6 (2014) 10.1016/j.apsusc.2014.02.060

DFT study of the Cr8 molecular magnet within chain-model approximations; Bellini V., Tomecka D., Brzostowski B., Wojciechowski M., Troiani F., Manghi F., Affronte M.; Lecture Notes in Computer Science (including subseries Lecture Notes in Artificial Intelligence and Lecture Notes in Bioinformatics) (8385 LNCS); 428-437 (2014) 10.1007/978-3-642-55195-6_40

Coherent ultrafast charge transfer in an organic photovoltaic blend; Falke S.M., Rozzi C.A., Brida D., Maiuri M., Amato M., Sommer E., De Sio A., Rubio A., Cerullo G., Molinari E., Lienau C.; Science (344); 1001-1005 (2014) 10.1126/science.1249771

Interaction with a gold surface reshapes the free energy landscape of alanine dipeptide; Bellucci L., Corni S.; Journal of Physical Chemistry C (118); 11357-11364 (2014) 10.1021/jp502494k

Power factor enhancement by inhomogeneous distribution of dopants in two-phase nanocrystalline systems; Neophytou N., Zianni X., Kosina H., Frabboni S., Lorenzi B., Narducci D.; Journal of Electronic Materials (43); 1896-1904 (2014) 10.1007/s11664-013-2898-z

Effect of ultrathin gold on the Ohmic-to-Schottky transition in Al/ZnO contacts: A first-principles investigation; Catellani A., Calzolari A., Ruini A.; Journal of Applied Physics (115); 043711 (2014) 10.1063/1.4862954

Zn vacancy induced green luminescence on non-polar surfaces in ZnO nanostructures; Fabbri F., Villani M., Catellani A., Calzolari A., Cicero G., Calestani D., Calestani G., Zappettini A., Dierre B., Sekiguchi T., Salviati G.; Scientific Reports (4); 5158 (2014) 10.1038/srep05158

Bridging density-functional and many-body perturbation theory: Orbital-density dependence in electronic-structure functionals; Ferretti A., Dabo I., Cococcioni M., Marzari N.; Physical Review B - Condensed Matter and Materials Physics (89); 195134 (2014) 10.1103/PhysRevB.89.195134

From micro- to nanomagnetic dots: Evolution of the eigenmode spectrum on reducing the lateral size; Carlotti G., Gubbiotti G., Madami M., Tacchi S., Hartmann F., Emmerling M., Kamp M., Worschech L.; Journal of Physics D: Applied Physics (47); 265001 (2014) 10.1088/0022-3727/47/26/265001

Defects and strain enhancements of second-harmonic generation in Si/Ge superlattices; Bertocchi M., Luppi E., Degoli E., Véniard V., Ossicini S.; Journal of Chemical Physics (140); 214705 (2014) 10.1063/1.4880756

Enhancement of the power factor in two-phase silicon-boron nanocrystalline alloys; Narducci D., Lorenzi B., Zianni X., Neophytou N., Frabboni S., Gazzadi G.C., Roncaglia A., Suriano F.; Physica Status Solidi (A) Applications and Materials Science (211); 1255-1258 (2014) 10.1002/pssa.201300130

Edge structures for nanoscale graphene Islands on Co(0001) surfaces; Prezzi D., Eom D., Rim K.T., Zhou H., Xiao S., Nuckolls C., Heinz T.F., Flynn G.W., Hybertsen M.S.; ACS Nano (8); 5765-5773 (2014) 10.1021/nn500583a

Hysteretic behaviour in a vacuum deposited submonolayer of single ion magnets; Klar D., Candini A., Joly L., Klyatskaya S., Krumme B., Ohresser P., Kappler J., Ruben M., Wende H.; Dalton Transactions (43); 10686-10689 (2014) 10.1039/c4dt01005a

Can small hydrophobic gold nanoparticles inhibit β2- microglobulin fibrillation?; Brancolini G., Toroz D., Corni S.; Nanoscale (6); 7903-7911 (2014) 10.1039/c4nr01514b

Tuning the growth mode of nanowires via the interaction among seeds, substrates and beam fluxes; Zannier V., Grillo V., Martelli F., Plaisier J., Lausi A., Rubini S.; Nanoscale (6); 8392-8399 (2014) 10.1039/c4nr01183j

Reentrant metallicity in the Hubbard model: The case of honeycomb nanoribbons; Manghi F., Petocchi F.; Physica Scripta (89); 075802 (2014) 10.1088/0031-8949/89/7/075802

Stationary States for Nonlinear Schrödinger Equations with Periodic Potentials; Fukuizumi R., Sacchetti A.; Journal of Statistical Physics (156); 707-738 (2014) 10.1007/s10955-014-1023-x

Trap densities and transport properties of pentacene metal-oxide- semiconductor transistors: II - Numerical modeling of dc characteristics; Basile A., Kyndiah A., Biscarini F., Fraboni B.; Journal of Applied Physics (115); 244505 (2014) 10.1063/1.4884856

Trap densities and transport properties of pentacene metal-oxide- semiconductor transistors. I. Analytical modeling of time-dependent characteristics; Basile A., Cramer T., Kyndiah A., Biscarini F., Fraboni B.; Journal of Applied Physics (115); 244504 (2014) 10.1063/1.4884855

Ground state structures and electronic excitations of biological chromophores at Quantum Monte Carlo/Many Body Green's Function Theory level; Varsano D., Coccia E., Pulci O., Conte A., Guidoni L.; Computational and Theoretical Chemistry (1040-1041); 338-346 (2014) 10.1016/j.comptc.2014.03.011

Kohn-Sham orbitals and potentials from quantum Monte Carlo molecular densities; Varsano D., Barborini M., Guidoni L.; Journal of Chemical Physics (140); 054102 (2014) 10.1063/1.4863213

Exciton-dominated optical response of ultra-narrow graphene nanoribbons; Denk R., Hohage M., Zeppenfeld P., Cai J., Pignedoli C., Söde H., Fasel R., Feng X., Müllen K., Wang S., Prezzi D., Ferretti A., Ruini A., Molinari E., Ruffieux P.; Nature Communications (5); 4253 (2014) 10.1038/ncomms5253

Unambiguous assignment of reduction potentials in diheme cytochromes; Daidone I., Paltrinieri L., Amadei A., Battistuzzi G., Sola M., Borsari M., Bortolotti C.; Journal of Physical Chemistry B (118); 7554-7560 (2014) 10.1021/jp506017a

Comparing the deposition mechanisms in suspension plasma spray (SPS) and solution precursor plasma spray (SPPS) deposition of yttria-stabilised zirconia (YSZ); Joulia A., Bolelli G., Gualtieri E., Lusvarghi L., Valeri S., Vardelle M., Rossignol S., Vardelle A.; Journal of the European Ceramic Society (34); 3925-3940 (2014) 10.1016/j.jeurceramsoc.2014.05.024

Surface investigation on Gd4M8 (M = Zn, Ni) single molecule coolers; Corradini V., Ghirri A., Candini A., Biagi R., Del Pennino U., De Renzi V., Dotti G., Otero E., Hooper T.N., Inglis R., Brechin E.K., Affronte M.; Advanced Functional Materials (24); 4782-4788 (2014) 10.1002/adfm.201400460

Ferromagnetic exchange coupling between Fe phthalocyanine and Ni(111) surface mediated by the extended states of graphene; Candini A., Bellini V., Klar D., Corradini V., Biagi R., De Renzi V., Kummer K., Brookes N., Del Pennino U., Wende H., Affronte M.; Journal of Physical Chemistry C (118); 17670-17676 (2014) 10.1021/jp5041663

Structural and morphological modifications of thermally reduced cerium oxide ultrathin epitaxial films on Pt(111); Luches P., Pagliuca F., Valeri S.; Physical Chemistry Chemical Physics (16); 18848-18857 (2014) 10.1039/c4cp02723j

Charge transfer rates at a bio-inorganic interface; Sun W., Ferretti A., Varsano D., Brancolini G., Corni S., Di Felice R.; Journal of Physical Chemistry C (118); 18820-18828 (2014) 10.1021/jp507346a

Anisotropy and size effects on the optical spectra of polycyclic aromatic hydrocarbons; Cocchi C., Prezzi D., Ruini A., Caldas M., Molinari E.; Journal of Physical Chemistry A (118); 6507-6513 (2014) 10.1021/jp503054j

Conductance fluctuations in Si nanowires studied from first-principles; Iori F., Ossicini S., Rurali R.; Journal of Applied Physics (116); 074303 (2014) 10.1063/1.4892673

The complex folding behavior of HIV-1-protease monomer revealed by optical-tweezer single-molecule experiments and molecular dynamics simulations; Caldarini M., Sonar P., Valpapuram I., Tavella D., Volonté C., Pandini V., Vanoni M., Aliverti A., Broglia R., Tiana G., Cecconi C.; Biophysical Chemistry (195); 32-42 (2014) 10.1016/j.bpc.2014.08.001

Phase transitions in supported lipid bilayers studied by AFM; Alessandrini A., Facci P.; Soft Matter (10); 7145-7164 (2014) 10.1039/c4sm01104j

Role of as in the anisotropic positioning of self-assembled InAs quantum dots; Arciprete F., Placidi E., Magri R., Fanfoni M., Balzarotti A., Patella F.; Materials Research Society Symposium Proceedings (1551); 3-9 (2014) 10.1557/opl.2013.892

Three dimensional analysis of the composition in solid alloys by variable probe in scanning transmission electron microscopy; Rotunno E., Albrecht M., Markurt T., Remmele T., Grillo V.; Ultramicroscopy (146); 62-70 (2014) 10.1016/j.ultramic.2014.07.003

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