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Mostrati risultati da 319 a 338 di 1.719
Titolo Data di pubblicazione Autori File
D-branes, rolling tachyons and vacuum string field theory 4-ott-2005 -
D-RESP: Dynamically generated electrostatic potential derived charges from quantum mechanics/molecular mechanics simulations 1-gen-2002 Laio, A. +
D-wave, dimer, and chiral states in the two-dimensional Hubbard model 1-gen-1991 Sorella, Sandro +
DADApy: Distance-based analysis of data-manifolds in Python 1-gen-2022 Glielmo, AldoMacocco, IuriDoimo, DiegoCarli, MatteoZeni, ClaudioWild, Rominad'Errico, MariaLaio, Alessandro +
Data segmentation based on the local intrinsic dimension 1-gen-2020 Allegra M.Facco E.Denti F.Laio A.Mira A.
Data-driven simulation and characterisation of gold nanoparticle melting 1-gen-2021 Zeni C.de Gironcoli S. +
Deciphering the folding kinetics of transmembrane helical proteins 1-gen-2000 Laio, A. +
Defect creation and Diffusion under electric fields from first-principles: the prototypical case of silicon dioxide 1-gen-2019 Salles, N.de Gironcoli, S.Giacomazzi, L. +
Defect-controlled transport properties of metallic atoms along carbon nanotube surfaces 1-gen-2007 Fabris, S.Baroni, S.Kiskinova, Maya +
Density effects in entangled solutions of linear and ring polymers 1-gen-2016 Nahali, NegarRosa, Angelo
Density functional perturbation theory for lattice dynamics with fully relativistic ultrasoft pseudopotentials: application to fcc-Pt and fcc-Au 1-gen-2007 Dal Corso, Andrea
Density functional perturbation theory for lattice dynamics with fully relativistic ultrasoft pseudopotentials: the magnetic case 1-gen-2019 Urru A.Dal Corso A.
Density functional theory without orbitals: a path towords very large scale electronic structure calculations 1-apr-1992 -
Density Peak clustering of protein sequences associated to a Pfam clan reveals clear similarities and interesting differences with respect to manual family annotation 1-gen-2021 Russo, E. T.Laio, A. +
Density-functional perturbation theory for quasi-harmonic calculations 1-gen-2010 Baroni, StefanoGiannozzi, Paolo +
Density-functional theory of the dielectric constant: gradient-corrected calculation for silicon 1-gen-1994 Dal Corso, A.Baroni, S.Resta, R.
Density-tunable pathway complexity in a minimalistic self-assembly model 1-gen-2022 Becchi, MatteoMicheletti, Cristian +
Dependence of the crystal lattice constant on isotopic composition: Theory and ab initio calculations for C, Si, and Ge 1-gen-1994 Baroni, S. +
Design of a Mott Multiferroic from a Nonmagnetic Polar Metal 1-gen-2015 Capone, Massimo +
Designing High-Affinity Peptides for Organic Molecules by Explicit Solvent Molecular Dynamics 1-gen-2015 Gladich, IvanRodriguez, A.Hong Enriquez, Rolando PabloGuida, FilomenaBerti, FedericoLaio, Alessandro
Mostrati risultati da 319 a 338 di 1.719
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