Browsing by Author Car, Roberto
Showing results 51 to 65 of 65
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Publication Date | Article Title | Author(s) |
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17-Apr-2020 | Quantum ESPRESSO toward the exascale | Giannozzi, Paolo; Baseggio, Oscar; Bonfà, Pietro; Brunato, Davide; Car, Roberto; et al |
8-Jan-2020 | Quantum momentum distribution and quantum entanglement in the deep tunneling regime | Wu, Yantao; Car, Roberto |
30-Apr-2020 | Raman spectrum and polarizability of liquid water from deep neural networks | Sommers, Grace M; Calegari Andrade, Marcos F; Zhang, Linfeng; Wang, Han; Car, Roberto |
11-Jan-2019 | Reliable and practical computational description of molecular crystal polymorphs | Hoja, Johannes; Ko, Hsin-Yu; Neumann, Marcus; Car, Roberto; DiStasio, Robert; et al |
1-Aug-2016 | Report on the sixth blind test of organic crystal structure prediction methods | Reilly, Anthony M.; Cooper, Richard I.; Adjiman, Claire S.; Bhattacharya, Saswata; Boese, A. Daniel; et al |
1-Oct-2012 | Roles of quantum nuclei and inhomogeneous screening in the x-ray absorption spectra of water and ice | Kong, Lingzhu; Wu, Xifan; Car, Roberto |
28-Aug-2018 | Root-growth of boron nitride nanotubes: experiments and ab initio simulations | Santra, Biswajit; Ko, Hsin-Yu; Yeh, Yao-Wen; Martelli, Fausto; Kaganovich, Igor; et al |
2-Jul-2018 | Searching for crystal-ice domains in amorphous ices | Martelli, Fausto; Giovambattista, Nicolas; Torquato, Salvatore; Car, Roberto |
14-Jan-2012 | Spherical momentum distribution of the protons in hexagonal ice from modeling of inelastic neutron scattering data | Flammini, Davide; Pietropaolo, Antonino; Senesi, Roberto; Andreani, Carla; McBride, Fiona; et al |
18-May-2018 | Thermal expansion in dispersion-bound molecular crystals | Ko, Hsin-Yu; DiStasio, Robert A; Santra, Biswajit; Car, Roberto |
15-May-2015 | Three-dimensional Dirac semimetals: Design principles and predictions of new materials | Gibson, QD; Schoop, Leslie M; Muechler, L; Xie, LS; Hirschberger, M; et al |
Dec-2016 | Topological Nonsymmorphic Metals from Band Inversion | Muechler, Lukas; Alexandradinata, A.; Neupert, Titus; Car, Roberto |
28-Nov-2017 | Variational Approach to Monte Carlo Renormalization Group | Wu, Yantao; Car, Roberto |
1-Jul-2022 | Viscosity in water from first-principles and deep-neural-network simulations | Malosso, Cesare; Zhang, Linfeng; Car, Roberto; Baroni, Stefano; Tisi, Davide |
15-Nov-2016 | A well-scaling natural orbital theory | Gebauer, Ralph; Cohen, Morrel H.; Car, Roberto |