Sfoglia per SSD
Topology-Based Detection and Tracking of Deadlocks Reveal Aging of Active Ring Melts
2024-01-01 Micheletti, Cristian; Chubak, Iurii; Orlandini, Enzo; Smrek, Jan
Total correlations of the diagonal ensemble herald the many-body localization transition
2015-01-01 Goold, J; Gogolin, C; Clark, Stephen Richard James Franz; Eisert, J; Scardicchio, A; Silva, Alessandro
Toward a transferable parametrization for carbon in a periodic semi-empirical molecular orbital scheme
1998-01-01 De Maria, L.; Peressi, M.; Baroni, S.
Toward a unified scoring function for native state discrimination and drug-binding pocket recognition
2018-01-01 Battisti, Anna; Zamuner, Stefano; Sarti, Edoardo; Laio, Alessandro
Toward Accurate Adsorption Energetics on Clay Surfaces
2016-01-01 Zen, Andrea; Roch, Loïc M; Cox, Stephen J; Hu, Xiao Liang; Sorella, Sandro; Alfè, Dario; Michaelides, Angelos
Toward an accurate and efficient theory of physisorption. I. Development of an augmented density-functional theory model
2008-01-01 Murdachaew, G.; de Gironcoli, Stefano Maria; Scoles, Giacinto
Toward Convergence in Folding Simulations of RNA Tetraloops: Comparison of Enhanced Sampling Techniques and Effects of Force Field Modifications
2022-01-01 Mlýnský, Vojtěch; Janeček, Michal; Kührová, Petra; Froehlking, Thorben; Otyepka, Michal; Bussi, Giovanni; Banáš, Pavel; Šponer, Jiří
Towards de novo RNA 3D Structure Prediction
2015-01-01 Bottaro, S.; Di Palma, F.; Bussi, G.
Towards high-temperature coherence-enhanced transport in heterostructures of a few atomic layers
2019-01-01 Kropf, C. M.; Valli, A.; Franceschini, P.; Celardo, G. L.; Capone, M.; Giannetti, C.; Borgonovi, F.
Towards high-throughput many-body perturbation theory: efficient algorithms and automated workflows
2023-01-01 Bonacci, M.; Qiao, J.; Spallanzani, N.; Marrazzo, A.; Pizzi, G.; Molinari, E.; Varsano, D.; Ferretti, A.; Prezzi, D.
Towards next-generation methods to optimize two-dimensional tensor networks: Algorithmic differentiation and applications to quantum magnets
2019-10-25 Hasik, Juraj
Towards Realistic Simulations of Structural Transformations in Solids by Metadynamics
2023-09-27 Badin, Matej
Towards the solution of the many-electron problem in real materials: Equation of state of the hydrogen chain with state-of-the-art many-body methods
2017-01-01 Motta, Mario; Ceperley, David M; Chan, Garnet Kin-Lic; Gomez, John A; Gull, Emanuel; Guo, Sheng; Jiménez-Hoyos, Carlos A.; Lan, Tran Nguyen; Li, Jia; Ma, Fengjie; Millis, Andrew J; Prokof’Ev, Nikolay V.; Ray, Ushnish; Scuseria, Gustavo E; Sorella, Sandro; Stoudenmire, Edwin M; Sun, Qiming; Tupitsyn, Igor S; White, Steven R; Zgid, Dominika; Zhang, Shiwei
Towards Very Large-Scale Electronic-Structure Calculations
1992-01-01 Baroni, S; Giannozzi, P.
Tracing the Entropy along a Reactive Pathway: The Energy As a Generalized Reaction Coordinate
2009-01-01 Michel, C.; Laio, A.; Milet, A.
Trajectory versus probability density entropy
2001-01-01 Bologna, M; Grigolini, P; Karagiorgis, M; Rosa, Angelo
Trans-cis switching mechanisms in proline analogues and their relevance for the gating of the 5-HT3 receptor
2009-01-01 Melis, C.; Bussi, G.; Lummis, S. C. R.; Molteni, C.
Transcriptional supercoiling boosts topoisomerase II-mediated knotting of intracellular DNA
2019-01-01 Valdes, A.; Coronel, L.; Martinez-Garcia, B.; Segura, J.; Dyson, S.; Diaz-Ingelmo, O.; Micheletti, C.; Roca, J.
Transient Dynamics of d-Wave Superconductors after a Sudden Excitation
2015-01-01 Peronaci, Francesco; Schirò, Marco; Capone, Massimo
Transport in out-of-equilibrium XXZ chains: Nonballistic behavior and correlation functions
2017-01-01 Piroli, Lorenzo; De Nardis, Jacopo; Collura, Mario; Bertini, Bruno; Fagotti, Maurizio
Legenda icone
- file ad accesso aperto
- file disponibili sulla rete interna
- file disponibili agli utenti autorizzati
- file disponibili solo agli amministratori
- file sotto embargo
- nessun file disponibile