Nature and strength of interlayer binding in graphite L Spanu, S Sorella, G Galli Physical review letters 103 (19), 196401, 2009 | 315 | 2009 |
Dielectric properties of water under extreme conditions and transport of carbonates in the deep Earth D Pan, L Spanu, B Harrison, DA Sverjensky, G Galli Proceedings of the National Academy of Sciences 110 (17), 6646-6650, 2013 | 184 | 2013 |
Stability of hydrocarbons at deep Earth pressures and temperatures L Spanu, D Donadio, D Hohl, E Schwegler, G Galli Proceedings of the National Academy of Sciences 108 (17), 6843-6846, 2011 | 96 | 2011 |
Raman spectra of liquid water from ab initio molecular dynamics: vibrational signatures of charge fluctuations in the hydrogen bond network Q Wan, L Spanu, GA Galli, F Gygi Journal of Chemical Theory and Computation 9 (9), 4124-4130, 2013 | 92 | 2013 |
Magnetism and superconductivity in the tt'-J model L Spanu, M Lugas, F Becca, S Sorella Phys. Rev. B 77, 024510, 2008 | 69 | 2008 |
NON-ABELIAN VORTEX AND CONFINEMENT K KONISHI, L SPANU International journal of modern physics: Particles and fields, gravitation …, 2003 | 59 | 2003 |
Dissecting the hydrogen bond: a Quantum Monte Carlo approach F Sterpone, L Spanu, L Ferraro, S Sorella, L Guidoni Journal of Chemical Theory and Computation 4 (9), 1428-1434, 2008 | 56 | 2008 |
A Perspective on the Electrochemical Oxidation of Methane to Methanol in Membrane Electrode Assemblies JC Fornaciari, D Primc, K Kawashima, BR Wygant, S Verma, L Spanu, ... ACS Energy Letters 5 (9), 2954-2963, 2020 | 54 | 2020 |
Entropy of Liquid Water from Ab Initio Molecular Dynamics C Zhang, L Spanu, G Galli The Journal of Physical Chemistry B 115 (48), 14190-14195, 2011 | 51 | 2011 |
Finite compressibility in the low-doping region of the two-dimensional model M Lugas, L Spanu, F Becca, S Sorella Physical Review B 74 (16), 165122, 2006 | 45 | 2006 |
Finite compressibility in the low-doping region of the two-dimensional t − J model M Lugas, L Spanu, F Becca, S Sorella Physical Review B 74 (16), 165122, 0 | 45* | |
Ab initio calculations for the β-tin diamond transition in silicon: Comparing theories with experiments S Sorella, M Casula, L Spanu, A Dal Corso Physical Review B 83 (7), 075119, 2011 | 41 | 2011 |
Ab initio investigation of the melting line of nitrogen at high pressure D Donadio, L Spanu, I Duchemin, F Gygi, G Galli Physical Review B 82 (2), 020102, 2010 | 40 | 2010 |
Effect of phase and size on surface sites in cobalt nanoparticles R Agrawal, P Phatak, L Spanu Catalysis Today 312, 174-180, 2018 | 30 | 2018 |
Solvation Properties of Microhydrated Sulfate Anion Clusters: Insights From ab initio Calculations Q Wan, L Spanu, GA Galli The Journal of Physical Chemistry B, 2012 | 27 | 2012 |
Electronic Structure of Aqueous Sulfuric Acid from First-Principles Simulations with Hybrid Functionals Q Wan, L Spanu, F Gygi, G Galli The Journal of Physical Chemistry Letters 5 (15), 2562-2567, 2014 | 26 | 2014 |
Resonating-valence-bond ground state of lithium nanoclusters D Nissenbaum, L Spanu, C Attaccalite, B Barbiellini, A Bansil American Physical Society, 2009 | 25 | 2009 |
Reversing Size-Dependent Trends in the Oxidation of Copper Clusters through Support Effects [Controlling the Degree of Oxidation of Copper Clusters Through Size and Support … N Mammen, L Spanu, EC Tyo, B Yang, A Halder, S Seifert, MJ Pellin, ... European Journal of Inorganic Chemistry 2018 (1), 2017 | 19 | 2017 |
Structures and vibrational frequencies of CO adsorbed on transition metals from calculations using the vdW-DF2 functional X Ma, A Genest, L Spanu, N Rösch Computational and Theoretical Chemistry 1069, 147-154, 2015 | 19 | 2015 |
Theoretical investigation of methane under pressure L Spanu, D Donadio, D Hohl, G Galli The Journal of chemical physics 130 (16), 164520, 2009 | 19 | 2009 |