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Browsing by Author Car, Roberto

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Showing results 55 to 65 of 65 < previous 
Publication DateArticle TitleAuthor(s)
1-Aug-2016Report on the sixth blind test of organic crystal structure prediction methodsReilly, Anthony M.; Cooper, Richard I.; Adjiman, Claire S.; Bhattacharya, Saswata; Boese, A. Daniel; et al
1-Oct-2012Roles of quantum nuclei and inhomogeneous screening in the x-ray absorption spectra of water and iceKong, Lingzhu; Wu, Xifan; Car, Roberto
28-Aug-2018Root-growth of boron nitride nanotubes: experiments and ab initio simulationsSantra, Biswajit; Ko, Hsin-Yu; Yeh, Yao-Wen; Martelli, Fausto; Kaganovich, Igor; et al
2-Jul-2018Searching for crystal-ice domains in amorphous icesMartelli, Fausto; Giovambattista, Nicolas; Torquato, Salvatore; Car, Roberto
14-Jan-2012Spherical momentum distribution of the protons in hexagonal ice from modeling of inelastic neutron scattering dataFlammini, Davide; Pietropaolo, Antonino; Senesi, Roberto; Andreani, Carla; McBride, Fiona; et al
18-May-2018Thermal expansion in dispersion-bound molecular crystalsKo, Hsin-Yu; DiStasio, Robert A; Santra, Biswajit; Car, Roberto
15-May-2015Three-dimensional Dirac semimetals: Design principles and predictions of new materialsGibson, QD; Schoop, Leslie M; Muechler, L; Xie, LS; Hirschberger, M; et al
Dec-2016Topological Nonsymmorphic Metals from Band InversionMuechler, Lukas; Alexandradinata, A.; Neupert, Titus; Car, Roberto
28-Nov-2017Variational Approach to MonteĀ Carlo Renormalization GroupWu, Yantao; Car, Roberto
1-Jul-2022Viscosity in water from first-principles and deep-neural-network simulationsMalosso, Cesare; Zhang, Linfeng; Car, Roberto; Baroni, Stefano; Tisi, Davide
15-Nov-2016A well-scaling natural orbital theoryGebauer, Ralph; Cohen, Morrel H.; Car, Roberto