Showing 1–20 of 27 results
/ Date/ Name
Jun 25, 2006Renormalization of Molecular Electronic Levels at Metal-Molecule InterfacesDec 7, 2000On the constitution of sodium at higher densitiesJan 27, 2002Low-Energy Linear Structures in Dense Oxygen: Implications for the $ε$-phaseApr 21, 2003First-principles study of adhesion at Cu/SiO$_2$ interfacesApr 5, 2001On the possibility of superconductivity at higher temperatures in sp-valent diboridesApr 23, 2002Enhanced polarization in strained BaTiO$_3$ from first principlesMar 23, 2001Ferromagnetic instabilities in atomically-thin lithium and sodium wiresNov 19, 2002Theory of polarization enhancement in epitaxial BaTiO$_3$/SrTiO$_3$ superlatticesJan 9, 2012Simultaneous Determination of Conductance and Thermopower of Single Molecule JunctionsDec 16, 2022Exciton lifetime and optical linewidth profile via exciton-phonon interactions: Theory and first-principles calculations for monolayer MoS$_2$Jul 2, 2004Tunability of the dielectric response of epitaxially strained SrTiO3 from first principlesJul 26, 2004First-principles study of spontaneous polarization in multiferroic BiFeO$_3$Jul 16, 2007Amine-Gold Linked Single-Molecule Junctions: Experiment and TheoryOct 9, 2001A first-principles study of the structure and lattice dielectric response of CaCu{3}Ti{4}O{12}Apr 8, 2003Extrinsic models for the dielectric response of CaCu{3}Ti{4}O{12}May 24, 2006Structural, electronic and magnetic properties of SrRuO$_3$ under epitaxial strainSep 9, 2002Lattice dielectric response of CdCu{3}Ti{4}O{12} and of CaCu{3}Ti{4}O{12} from first principlesJan 8, 2009Mechanically-Controlled Binary Conductance Switching of a Single-Molecule JunctionNov 8, 2010Chemical Raman Enhancement of Organic Adsorbates on Metal SurfacesMar 14, 2002Effective-Hamiltonian modeling of external pressures in ferroelectric perovskites