Sfoglia per Autore
High-pressure low-symmetry phases of cesium halides
1995-01-01 Buongiorno Nardelli, M.; Baroni, S.; Giannozzi, Paolo
High pressure lattice instabilities and structural phase transformations in solids from ab-initio lattice dynamics
1997-01-01 Baroni, S.; Giannozzi, P.
Raman cross section for the pentagonal-pinch mode in buckminsterfullerene C-60
1997-01-01 Lorentzen, J. D.; Guha, S.; Menendez, J.; Giannozzi, P.; Baroni, S.
Phonons and related crystal properties from density-functional perturbation theory
2001-01-01 Baroni, S.; de Gironcoli, S.; Dal Corso, A.; Giannozzi, P.
First-principles codes for computational crystallography in the Quantum-ESPRESSO package
2005-01-01 Scandolo, S.; Giannozzi, P.; Cavazzoni, C.; de Gironcoli, S.; Pasquarello, A.; Baroni, S.
SixC1−xO2 alloys: A possible route to stabilize carbon-based silica-like solids?
2007-01-01 Aravindh, A; Arkundato, A; Barman, S; Baroni, S; Bhargava, Bl; Chandrakumar, Krs; Chen, W; Cherian, R; Dal Corso, A; Datta, S; de Gironcoli, S; Dhayal, Ss; Dixit, Ak; Dutta, S; D'Yachkov, P; Floare, Cg; Ganguli, N; Ganguly, S; Gebauer, R; Ghosh, S; Giannozzi, P; Govind, ; Hatt, Aj; Hembram, Kpss; Imam, M; Jayalakshmi, V; Jayanthi, Cs; Kelkar, T; Kumar, A; Lee, Jh; Lee, Ms; Lonappan, D; Mahadevan, P; Mallajosyula, Ss; Marathe, M; Marzari, N; Melot, B; Miller, N; Morrone, J; Nanavati, S; Nanayakkara, A; Nandi, Pk; Narasimhan, S; Natarajan, B; Parvin, F; Paul, S; Pradhan, K; Praveena, G; Prasad, Dlvk; Poswal, Hk; Pujari, B; Pushpa, R; Reddy, Khk; Saha, Sk; Sbraccia, C; Scandolo, S; Seal, P; Shafai, Gs; Shanavas, Kv; Simrall, Joh; Srirangarajan, A; Srivastava, V; Talati, Mk; Tantirungrotechai, Y; Tarafder, K; Thomas, T; Uthayathasan, T.
Density-functional perturbation theory for quasi-harmonic calculations
2010-01-01 Baroni, Stefano; Giannozzi, Paolo; Isaev, Eyvaz
Reproducibility in density functional theory calculations of solids
2016-01-01 Lejaeghere, Kurt; Bihlmayer, Gustav; Björkman, Torbjörn; Blaha, Peter; Blügel, Stefan; Blum, Volker; Caliste, Damien; Castelli, Ivano E; Clark, Stewart J; Dal Corso, Andrea; de Gironcoli, Stefano Maria; Deutsch, Thierry; Dewhurst, John Kay; Di Marco, Igor; Draxl, Claudia; Dułak, Marcin; Eriksson, Olle; Flores Livas, José A; Garrity, Kevin F; Genovese, Luigi; Giannozzi, Paolo; Giantomassi, Matteo; Goedecker, Stefan; Gonze, Xavier; Grånäs, Oscar; Gross, E. K. U; Gulans, Andris; Gygi, François; Hamann, D. R; Hasnip, Phil J; Holzwarth, N. A. W; Iuşan, Diana; Jochym, Dominik B; Jollet, François; Jones, Daniel; Kresse, Georg; Koepernik, Klaus; Kucukbenli, Emine; Kvashnin, Yaroslav O; Locht, Inka L. M; Lubeck, Sven; Marsman, Martijn; Marzari, Nicola; Nitzsche, Ulrike; Nordström, Lars; Ozaki, Taisuke; Paulatto, Lorenzo; Pickard, Chris J; Poelmans, Ward; Probert, Matt I. J; Refson, Keith; Richter, Manuel; Rignanese, Gian Marco; Saha, Santanu; Scheffler, Matthias; Schlipf, Martin; Schwarz, Karlheinz; Sharma, Sangeeta; Tavazza, Francesca; Thunström, Patrik; Tkatchenko, Alexandre; Torrent, Marc; Vanderbilt, David; van Setten, Michiel J; Van Speybroeck, Veronique; Wills, John M; Yates, Jonathan R; Zhang, Guo Xu; Cottenier, Stefaan
Quantum ESPRESSO toward the exascale
2020-01-01 Giannozzi, P.; Baseggio, O.; Bonfa, P.; Brunato, D.; Car, R.; Carnimeo, I.; Cavazzoni, C.; De Gironcoli, S.; Delugas, P.; Ferrari Ruffino, F.; Ferretti, A.; Marzari, N.; Timrov, I.; Urru, A.; Baroni, S.
Quantum ESPRESSO: One Further Step toward the Exascale
2023-01-01 Carnimeo, Ivan; Affinito, Fabio; Baroni, Stefano; Baseggio, Oscar; Bellentani, Laura; Bertossa, Riccardo; Delugas, Pietro Davide; Ruffino, Fabrizio Ferrari; Orlandini, Sergio; Spiga, Filippo; Giannozzi, Paolo
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