BARONI, STEFANO
BARONI, STEFANO
Istituto Officina dei Materiali - IOM -
Growth and Redox Properties of Boron on Al(111): Competing Affinities in the Case of Honeycomb AlB2
2024 Biasin, P.; Safari, M.; Ghidorsi, E.; Baronio, S.; Scardamaglia, M.; Preobrajenski, A. B.; Vinogradov, N. A.; Sala, A.; Cepek, C.; de Gironcoli, S.; Baroni, S.; Vesselli, E.
Discovery of a natural cyan blue: A unique food-sourced anthocyanin could replace synthetic brilliant blue
2021 Denish, Pamela R.; Fenger, Julie-Anne; Powers, Randall; Sigurdson, Gregory T.; Grisanti, Luca; Guggenheim, Kathryn G.; Laporte, Sara; Li, Julia; Kondo, Tadao; Magistrato, Alessandra; Moloney, Mícheál P.; Riley, Mary; Rusishvili, Mariami; Ahmadiani, Neda; Baroni, Stefano; Dangles, Olivier; Giusti, Monica; Collins, Thomas M.; Didzbalis, John; Yoshida, Kumi; Siegel, Justin B.; Robbins, Rebecca J.
Modeling heat transport in crystals and glasses from a unified lattice-dynamical approach
2019 Isaeva, L; Barbalinardo, G; Donadio, D; Baroni, S
Theory and Numerical Simulation of Heat Transport in Multicomponent Systems
2019 Bertossa R.; Grasselli F.; Ercole L.; Baroni S.
Topological quantization and gauge invariance of charge transport in liquid insulators
2019 Grasselli, F; Baroni, S
Unraveling the molecular mechanisms of color expression in anthocyanins
2019 Rusishvili, Mariami; Grisanti, Luca; Laporte, Sara; Micciarelli, Marco; Rosa, Marta; Robbins, Rebecca J.; Collins, Tom; Magistrato, Alessandra; Baroni, Stefano
Spin dynamics from time-dependent density functional perturbation theory
2018 Gorni T.; Timrov I.; Baroni S.
Ab initio study of electron energy loss spectra of bulk bismuth up to 100 eV
2017 Timrov I.; Markov M.; Gorni T.; Raynaud M.; Motornyi O.; Gebauer R.; Baroni S.; Vast N.
Accurate thermal conductivities from optimally short molecular dynamics simulations
2017 Ercole L.; Marcolongo A.; Baroni S.
Gauge Invariance of Thermal Transport Coefficients
2016 Ercole L.; Marcolongo A.; Umari P.; Baroni S.
Sampling Molecular Conformers in Solution with Quantum Mechanical Accuracy at a Nearly Molecular-Mechanics Cost
2016 Rosa, M; Micciarelli, M; Laio, A; Baroni, S
Approximate treatment of semicore states in GW calculations with application to Au clusters
2014 Xian, Jiawei; Baroni, Stefano; Umari, P.
Energy-level alignment in organic dye-sensitized TiO<sub>2</sub> from GW calculations
2013 Umari, P; Giacomazzi, L; De Angelis, F; Pastore, M; Baroni, Stefano
Accelerating GW calculations with optimal polarizability basis
2011 Umari, P; Qian, X; Marzari, N; Stenuit, G; Giacomazzi, L; Baroni, S
Dielectric and Thermal Effects on the Optical Properties of Natural Dyes: A Case Study on Solvated Cyanin
2011 Osman Baris Malcioglu; Arrigo Calzolari; Ralph Gebauer; Daniele Varsano;Stefano Baroni
Itinerant ferromagnetic phase of the Hubbard model
2011 Carleo, Giuseppe; Moroni, Saverio; Becca, Federico; Baroni, Stefano
turboTDDFT - A code for the simulation of molecular spectra using the Liouville-Lanczos approach to time-dependent density-functional perturbation theory
2011 Malcioglu, Osman Baris; Gebauer, Ralph; Rocca, Dario; Baroni, Stefano
GW quasiparticle spectra from occupied states only
2010 Umari, P.; Stenuit, Geoffrey; Baroni, Stefano
Order-disorder phase boundary between ice VII and VIII obtained by first principles
2010 Umemoto, Koichiro; Wentzcovitch, Renata M.; de Gironcoli, Stefano; Baroni, Stefano
QUANTUM ESPRESSO: A modular and open-source software project for quantum simulations of materials
2009 Giannozzi, P; Baroni, S; Bonini, N; Calandra, M; Car, R; Cavazzoni, C; Ceresoli, D; L Chiarotti, G; Cococcioni, M; Dabo, I; DAL CORSO, Andrea; Fabris, S; Fratesi, G; DE GIRONCOLI, STEFANO MARIA; Gebauer, R; Gerstmann, U; Gougoussis, C; Kokalj, A; Lazzeri, M; Martinsamos, L; Marzari, N; Mauri, F; Mazzarello, R; Paolini, S; Pasquarello, A; Paulatto, L; Sbraccia, C; Scandolo, S; Sclauzero, G; P Seitsonen, A; Smogunov, A; Umari, P; M Wentzcovitch, R
| Titolo | Data di pubblicazione | Autore(i) | File |
|---|---|---|---|
| Growth and Redox Properties of Boron on Al(111): Competing Affinities in the Case of Honeycomb AlB2 | 1-gen-2024 | Biasin, P.; Safari, M.; Ghidorsi, E.; Baronio, S.; Scardamaglia, M.; Preobrajenski, A. B.; Vinogradov, N. A.; Sala, A.; Cepek, C.; de Gironcoli, S.; Baroni, S.; Vesselli, E. | |
| Discovery of a natural cyan blue: A unique food-sourced anthocyanin could replace synthetic brilliant blue | 1-gen-2021 | Denish, Pamela R.; Fenger, Julie-Anne; Powers, Randall; Sigurdson, Gregory T.; Grisanti, Luca; Guggenheim, Kathryn G.; Laporte, Sara; Li, Julia; Kondo, Tadao; Magistrato, Alessandra; Moloney, Mícheál P.; Riley, Mary; Rusishvili, Mariami; Ahmadiani, Neda; Baroni, Stefano; Dangles, Olivier; Giusti, Monica; Collins, Thomas M.; Didzbalis, John; Yoshida, Kumi; Siegel, Justin B.; Robbins, Rebecca J. | |
| Modeling heat transport in crystals and glasses from a unified lattice-dynamical approach | 1-gen-2019 | Isaeva, L; Barbalinardo, G; Donadio, D; Baroni, S | |
| Theory and Numerical Simulation of Heat Transport in Multicomponent Systems | 1-gen-2019 | Bertossa R.; Grasselli F.; Ercole L.; Baroni S. | |
| Topological quantization and gauge invariance of charge transport in liquid insulators | 1-gen-2019 | Grasselli, F; Baroni, S | |
| Unraveling the molecular mechanisms of color expression in anthocyanins | 1-gen-2019 | Rusishvili, Mariami; Grisanti, Luca; Laporte, Sara; Micciarelli, Marco; Rosa, Marta; Robbins, Rebecca J.; Collins, Tom; Magistrato, Alessandra; Baroni, Stefano | |
| Spin dynamics from time-dependent density functional perturbation theory | 1-gen-2018 | Gorni T.; Timrov I.; Baroni S. | |
| Ab initio study of electron energy loss spectra of bulk bismuth up to 100 eV | 1-gen-2017 | Timrov I.; Markov M.; Gorni T.; Raynaud M.; Motornyi O.; Gebauer R.; Baroni S.; Vast N. | |
| Accurate thermal conductivities from optimally short molecular dynamics simulations | 1-gen-2017 | Ercole L.; Marcolongo A.; Baroni S. | |
| Gauge Invariance of Thermal Transport Coefficients | 1-gen-2016 | Ercole L.; Marcolongo A.; Umari P.; Baroni S. | |
| Sampling Molecular Conformers in Solution with Quantum Mechanical Accuracy at a Nearly Molecular-Mechanics Cost | 1-gen-2016 | Rosa, M; Micciarelli, M; Laio, A; Baroni, S | |
| Approximate treatment of semicore states in GW calculations with application to Au clusters | 1-gen-2014 | Xian, Jiawei; Baroni, Stefano; Umari, P. | |
| Energy-level alignment in organic dye-sensitized TiO<sub>2</sub> from GW calculations | 1-gen-2013 | Umari, P; Giacomazzi, L; De Angelis, F; Pastore, M; Baroni, Stefano | |
| Accelerating GW calculations with optimal polarizability basis | 1-gen-2011 | Umari, P; Qian, X; Marzari, N; Stenuit, G; Giacomazzi, L; Baroni, S | |
| Dielectric and Thermal Effects on the Optical Properties of Natural Dyes: A Case Study on Solvated Cyanin | 1-gen-2011 | Osman Baris Malcioglu; Arrigo Calzolari; Ralph Gebauer; Daniele Varsano;Stefano Baroni | |
| Itinerant ferromagnetic phase of the Hubbard model | 1-gen-2011 | Carleo, Giuseppe; Moroni, Saverio; Becca, Federico; Baroni, Stefano | |
| turboTDDFT - A code for the simulation of molecular spectra using the Liouville-Lanczos approach to time-dependent density-functional perturbation theory | 1-gen-2011 | Malcioglu, Osman Baris; Gebauer, Ralph; Rocca, Dario; Baroni, Stefano | |
| GW quasiparticle spectra from occupied states only | 1-gen-2010 | Umari, P.; Stenuit, Geoffrey; Baroni, Stefano | |
| Order-disorder phase boundary between ice VII and VIII obtained by first principles | 1-gen-2010 | Umemoto, Koichiro; Wentzcovitch, Renata M.; de Gironcoli, Stefano; Baroni, Stefano | |
| QUANTUM ESPRESSO: A modular and open-source software project for quantum simulations of materials | 1-gen-2009 | Giannozzi, P; Baroni, S; Bonini, N; Calandra, M; Car, R; Cavazzoni, C; Ceresoli, D; L Chiarotti, G; Cococcioni, M; Dabo, I; DAL CORSO, Andrea; Fabris, S; Fratesi, G; DE GIRONCOLI, STEFANO MARIA; Gebauer, R; Gerstmann, U; Gougoussis, C; Kokalj, A; Lazzeri, M; Martinsamos, L; Marzari, N; Mauri, F; Mazzarello, R; Paolini, S; Pasquarello, A; Paulatto, L; Sbraccia, C; Scandolo, S; Sclauzero, G; P Seitsonen, A; Smogunov, A; Umari, P; M Wentzcovitch, R |