Publications

Showing entries 161 - 180 out of 188

2010

Allegretti F, Parteder G, Gragnaniello L, Surnev SL, Netzer FP, Barolo A et al. Strained c(4 x 2) CoO(100)-like monolayer on Pd(100): Experiment and theory. Surface Science. 2010;604(5-6):529-534. doi: 10.1016/j.susc.2009.12.018
Franchini C, Sanna A, Marsman M, Kresse G. Structural, vibrational, and quasiparticle properties of the Peierls semiconductor BaBiO3: A hybrid functional and self-consistent GW + vertex-corrections study. Physical Review B. 2010;81(8):085213. doi: 10.1103/PhysRevB.81.085213

2009

Dona E, Cordin M, Deisl C, Bertel E, Franchini C, Zucca R et al. Halogen-Induced Corrosion of Platinum. Journal of the American Chemical Society. 2009;131(8):2827-2829. doi: 10.1021/ja809674n
Chen XQ, Fu CL, Franchini C, Podloucky R. Hybrid density-functional calculation of the electronic and magnetic structures of tetragonal CuO. Physical Review B. 2009;80(9):094527. doi: 10.1103/PhysRevB.80.094527
Franchini C, Zabloudil J, Podloucky R, Allegretti F, Li F, Surnev SL et al. Interplay between magnetic, electronic, and vibrational effects in monolayer Mn3O4 grown on Pd(100). Journal of Chemical Physics. 2009;130(12):124707. doi: 10.1063/1.3097957
Franchini C, Kresse G, Podloucky R. Polaronic Hole Trapping in Doped BaBiO3. Physical Review Letters. 2009;102(25):256402. doi: 10.1103/PhysRevLett.102.256402
Franchini C, Podloucky R, Allegretti F, Li F, Parteder G, Surnev SL et al. Structural and vibrational properties of two-dimensional MnxOy layers on Pd(100): Experiments and density functional theory calculations. Physical Review B. 2009;79(3):035420. doi: 10.1103/PhysRevB.79.035420
Li F, Parteder G, Allegretti F, Franchini C, Podloucky R, Surnev SL et al. Two-dimensional manganese oxide nanolayers on Pd(100): The surface phase diagram. Journal of Physics: Condensed Matter. 2009;21(13):134008. doi: 10.1088/0953-8984/21/13/134008

2007

Floris A, Sanna A, Lueders M, Profeta G, Lathiotakis NN, Marques MAL et al. Superconducting properties of MgB2 from first principles. Physica C: Superconductivity and its Applications. 2007 Jun 1;456(1-2):45-53. doi: 10.1016/j.physc.2007.01.026
Bayer V, Franchini C, Podloucky R. Ab initio study of the structural, electronic, and magnetic properties of MnO(100) and MnO(110). Physical Review B. 2007;75(3):035404. doi: 10.1103/PhysRevB.75.035404
Allegretti F, Franchini C, Bayer V, Leitner M, Parteder G, Xu B et al. Epitaxial stabilization of MnO(111) overlayers on a Pd(100) surface. Physical Review B. 2007;75(22):224120. doi: 10.1103/PhysRevB.75.224120
Bayer V, Podloucky R, Franchini C, Allegretti F, Xu B, Parteder G et al. Formation of Mn3O4(001) on MnO(001): Surface and interface structural stability. Physical Review B. 2007;76(16):165428. doi: 10.1103/PhysRevB.76.165428
Franchini C, Podloucky R, Paier J, Marsman M, Kresse G. Ground-state properties of multivalent manganese oxides: Density functional and hybrid density functional calculations. Physical Review B. 2007;75(19):195128. doi: 10.1103/PhysRevB.75.195128

2006

Sanna A, Franchini C, Floris A, Profeta G, Lathiotakis NN, Luders M et al. Ab initio prediction of pressure-induced superconductivity in potassium. Physical Review B. 2006 Apr;73(14):144512. doi: 10.1103/PhysRevB.73.144512
Profeta G, Franchini C, Lathiotakis NN, Floris A, Sanna A, Marques MAL et al. Superconductivity in lithium, potassium, and aluminum under extreme pressure: A first-principles study. Physical Review Letters. 2006 Feb 3;96(4):047003. doi: 10.1103/PhysRevLett.96.047003
Franchini C, Bayer V, Podloucky R, Parteder G, Surnev SL, Netzer FP. Density functional study of the polar MnO(111) surface. Physical Review B. 2006;73(15):1-14. doi: 10.1103/PhysRevB.73.155402

2005

Continenza A, Profeta G, Floris A, Franchini C, Massidda S, Lathiotakis NN et al. Ab-initio computation of superconducting properties of elemental superconductors and MgB2. Journal of Superconductivity. 2005 Nov;18(5-6):649-652. doi: 10.1007/s10948-005-0052-8
Franchini C, Sanna A, Massidda S, Gauzzi A. Chemical-pressure-induced modifications on the magnetic and electronic properties of Ba1-xSrxVS3. Europhysics Letters. 2005 Sept;71(6):952-958. doi: 10.1209/epl/i2005-10182-3
Floris A, Profeta G, Lathiotakis NN, Luders M, Marques MAL, Franchini C et al. Superconducting properties of MgB2 from first principles. Physical Review Letters. 2005 Jan 28;94(3):037004. doi: 10.1103/PhysRevLett.94.037004
Franchini C, Bayer V, Podloucky R, Paier J, Kresse G. Density functional theory study of MnO by a hybrid functional approach. Physical Review B. 2005;72(4):045132. doi: 10.1103/PhysRevB.72.045132
Showing entries 161 - 180 out of 188