Items where Author is "Monserrat, Bartomeu"

Hunt, Ryan James and Monserrat, Bartomeu and Zolyomi, Viktor and Drummond, Neil (2020) Diffusion quantum Monte Carlo and GW study of the electronic properties of monolayer and bulk hexagonal boron nitride. Physical Review B: Condensed Matter and Materials Physics, 101 (20): 205115. ISSN 1098-0121

Monserrat, Bartomeu and Drummond, Neil David and Dalladay-Simpson, Philip and Howie, Ross and Lopez Rios, Pablo and Gregoryanz, Eugene and Pickard, C. J. and Needs, Richard (2018) Structure and metallicity of phase V of hydrogen. Physical review letters, 120 (25): 255701. ISSN 1079-7114

Mostaani, Elaheh and Monserrat, Bartomeu and Drummond, Neil David and Lambert, Colin John (2016) Quasiparticle and excitonic gaps of one-dimensional carbon chains. Physical Chemistry Chemical Physics, 18 (22). pp. 14810-14821. ISSN 1463-9076

Drummond, Neil D. and Monserrat, Bartomeu and Lloyd-Williams, Jonathan H. and Rios, P. Lopez and Pickard, Chris J. and Needs, R. J. (2015) Quantum Monte Carlo study of the phase diagram of solid molecular hydrogen at extreme pressures. Nature Communications, 6: 7794. ISSN 2041-1723

Monserrat, Bartomeu and Drummond, Neil and Pickard, Chris J. and Needs, R. J. (2014) Electron-phonon coupling and the metallization of solid helium at terapascal pressures. Physical review letters, 112 (5): 055504. ISSN 0031-9007

Monserrat, Bartomeu and Drummond, Neil and Needs, R. J. (2013) Anharmonic vibrational properties in periodic systems: energy, electron-phonon coupling, and stress. Physical review B, 87 (14): 144302. ISSN 1550-235X