A. Alexandradinata, A. Nelson, A. A. Soluyanov, Teleportation of Berry curvature on the surface of a Hopf insulator , Physical Review B 103 , 045107 (2021). [Open Access URL] Soluyanov / Project(s): DD6 V. L. Deringer, N. Bernstein, G. Csányi, C. Ben Mahmoud, M. Ceriotti, M. Wilson, D. A. Drabold, S. R. Elliott, Origins of structural and electronic transitions in disordered silicon , Nature 589 , 59–64 (2021). [Open Access URL] Dataset on Zenodo. Ceriotti / Project(s): DD1 F. Giustino, J. H. Lee, F. Trier, M. Bibes, S. M. Winter, R. Valentí, Y. Son, L. Taillefer, C. Heil, A. I. Figueroa, B. Plaçais, Q. Wu, O. V. Yazyev, E. P. A. M. Bakkers, J. Nygård, P. Forn-Díaz, S. D. Franceschi, J. W. McIver, L. E. F. F. Torres, T. Low, A. Kumar, R. Galceran, S. O. Valenzuela, M. V. Costache, A. Manchon, E. Kim, G. R. Schleder, A. Fazzio, S. Roche, The 2020 Quantum Materials Roadmap , JPhys Materials 3 , 042006 (2021). [Open Access URL] Yazyev / Project(s): DD6 L. Indrizzi, N. Ohannessian, D. Pergolesi, T. Lippert, E. Gilardi, Pulsed Laser Deposition as a Tool for the Development of All Solid-State Microbatteries , Helvetica Chimica Acta 104 , e2000203 (2021). Pergolesi / Project(s): INC1 F. Libbi, N. Bonini, N. Marzari, Thermomechanical properties of honeycomb lattices from internal-coordinates potentials: the case of graphene and hexagonal boron nitride , 2D Materials 8 , 015026 (2021). [Open Access URL] Dataset on Materials Cloud. Marzari / Project(s): DD3 L. M. Mateo, Q. Sun, K. Eimre, C. A. Pignedoli, T. Torres, R. Fasel, G. Bottari, On-Surface Synthesis of Singly and Doubly Porphyrin-Capped Graphene Nanoribbon Segments , Chemical Science 12 , 247 (2021). [Open Access URL] Dataset on Materials Cloud. Fasel , Passerone / Project(s): DD3 V. Rizzi, L. Bonati, N. Ansari, M. Parrinello, The role of water in host-guest interaction , Nature Communications 12 , 93 (2021). [Open Access URL] Dataset on Materials Cloud. Parrinello / Project(s): DD1 T. Sohier, M. Gibertini, N. Marzari, Profiling novel high-conductivity 2D semiconductors , 2D Materials 8 , 015025 (2021).[Open Access URL] Dataset on Materials Cloud. Marzari / Project(s): DD3 M. Uhrin, S. P. Huber, J. Yu, N. Marzari, G. Pizzi, Workflows in AiiDA: Engineering a high-throughput, event-based engine for robust and modular computational workflows , Computational Materials Science 187 , 110086 (2021). [Open Access URL] Marzari , Pizzi / Project(s): OSP A. V. Yakutovich, O. S. Kristjan Eimre, L. Talirz, C. S. Adorf, C. W. Andersen, E. Ditler, D. Du, D. Passerone, B. Smit, N. Marzari, G. Pizzi, C. A. Pignedoli, AiiDAlab – an ecosystem for developing, executing, and sharing scientific workflows , Computational Materials Science 188 , 110165 (2021). [Open Access URL] Marzari , Passerone , Pizzi , Smit / Project(s): DD4 , OSP
