Risultati della ricerca - Das, Sambit

Intrinsic ductility enhancement in Mg alloys elucidated via large-scale ab-initio calculations di Das, Sambit, Gavini, Vikram

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Probabilities and Potentialities of SHG-led Women Entrepreneurship in the Fish Processing and Value Addition Sector di Dey, Suman, Das, Sambit

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Tucker tensor approach for accelerating exchange computations in a real-space finite-element discretization of generalized Kohn-Sham density functional theory di Subramanian, Vishal, Das, Sambit, Gavini, Vikram

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Fast and scalable finite-element based approach for density functional theory calculations using projector-augmented wave method di Ramakrishnan, Kartick, Das, Sambit, Motamarri, Phani

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Field theoretic atomistics: Learning thermodynamic and variational surrogate to density functional theory di Das, Sambit, Kanungo, Bikash, Paul, Arghadwip, Gavini, Vikram

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Quasicrystal bulk and surface energies from density functional theory di Baek, Woohyeon, Das, Sambit, Tan, Shibo, Gavini, Vikram, Sun, Wenhao

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An Atomic Cluster Expansion Potential for Twisted Multilayer Graphene di Wang, Yangshuai, Clark, Drake, Das, Sambit, Zhu, Ziyan, Massatt, Daniel, Gavini, Vikram, Luskin, Mitchell, Ortner, Christoph

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Towards exascale fully relativistic pseudopotential density functional theory calculations enabled by mixed-precision computation and compressed-communication using residual based... di Kodali, Nikhil, Panigrahi, Gourab, Gupta, Nishant, Ramakrishnan, Kartick, G, Sundaresan, Panch, Rudra, Das, Sambit, Rao, Vishwas, Motamarri, Phani

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MiMiC: A High-Performance Framework for Multiscale Molecular Dynamics Simulations di Antalík, Andrej, Levy, Andrea, Kvedaravičiūtė, Sonata, Johnson, Sophia K., Carrasco-Busturia, David, Raghavan, Bharath, Mouvet, François, Acocella, Angela, Das, Sambit, Gavini, Vikram, Mandelli, Davide, Ippoliti, Emiliano, Meloni, Simone, Carloni, Paolo, Rothlisberger, Ursula, Olsen, Jógvan Magnus Haugaard

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