المؤلفون: Grazioli, Cesare, Baseggio, Oscar, Stener, Mauro, Fronzoni, Giovanna, de Simone, Monica, Coreno, Marcello, Guarnaccio, Ambra, Aantagata, Antonio, D'Auria, Maurizio

مصطلحات موضوعية: Condensed Matter - Materials Science

URL الوصول: http://arxiv.org/abs/2307.11715

المؤلفون: Toffoli, Daniele, Lentini Campallegio, Claudio, Pistillo, Simone, Micheloni, Simone, Schio, Luca, Tormen, Massimo, Floreano, Luca, Costantini, Roberto, Dell’Angela, Martina, Morgante, Alberto, Fronzoni, Giovanna, Stener, Mauro, Cossaro, Albano

المساهمون: Universit? degli Studi di Trieste, NextGenerationEU, Beneficientia Stiftung

المصدر: The Journal of Physical Chemistry C ; volume 129, issue 2, page 1475-1484 ; ISSN 1932-7447 1932-7455

الاتاحة: https://doi.org/10.1021/acs.jpcc.4c06855
https://pubs.acs.org/doi/pdf/10.1021/acs.jpcc.4c06855

المؤلفون: Zerbato, Elena, Farris, Riccardo, Fronzoni, Giovanna, Neyman, Konstantin M, Stener, Mauro, Bruix, Albert

المساهمون: Zerbato, Elena, Farris, Riccardo, Fronzoni, Giovanna, Neyman, Konstantin M, Stener, Mauro, Bruix, Albert

مصطلحات موضوعية: Adsorption, Energy, Metal nanoparticle, Oxidation, Plasmonics

Relation: info:eu-repo/semantics/altIdentifier/pmid/38039331; volume:127/2023; issue:49; firstpage:10412; lastpage:10424; numberofpages:13; journal:THE JOURNAL OF PHYSICAL CHEMISTRY. A.; https://hdl.handle.net/11368/3066778; info:eu-repo/semantics/altIdentifier/scopus/2-s2.0-85179786224

الاتاحة: https://hdl.handle.net/11368/3066778
https://doi.org/10.1021/acs.jpca.3c05801
https://pubs.acs.org/doi/10.1021/acs.jpca.3c05801

المؤلفون: Mattoso, Samuel Henrique, Brumas, Véronique, Evangelisti, Stefano, Fronzoni, Giovanna, Leininger, Thierry, Stener, Mauro

المساهمون: Mattoso, Samuel Henrique, Brumas, Véronique, Evangelisti, Stefano, Fronzoni, Giovanna, Leininger, Thierry, Stener, Mauro

مصطلحات موضوعية: Chemical structure, Electronic structure, Energy, Wave function

Relation: info:eu-repo/semantics/altIdentifier/pmid/37939011; volume:127/2023; issue:46; firstpage:9723; lastpage:9732; numberofpages:10; journal:THE JOURNAL OF PHYSICAL CHEMISTRY. A.; https://hdl.handle.net/11368/3066759; info:eu-repo/semantics/altIdentifier/scopus/2-s2.0-85177797820

الاتاحة: https://hdl.handle.net/11368/3066759
https://doi.org/10.1021/acs.jpca.3c05062
https://pubs.acs.org/doi/full/10.1021/acs.jpca.3c05062

المؤلفون: Plekan, Oksana, Ponzi, Aurora, Grazioli, Cesare, Coreno, Marcello, de Simone, Monica, Morini, Filippo, Bernes, Elisa, Fronzoni, Giovanna, Toffoli, Daniele

المصدر: Journal of Physics B: Atomic, Molecular & Optical Physics; 1/14/2025, Vol. 58 Issue 1, p1-12, 12p

مصطلحات موضوعية: PHOTOELECTRON spectroscopy, ULTRAVIOLET spectroscopy, MOLECULAR orbitals, ELECTRONIC excitation, X-ray spectroscopy, ELECTRON configuration, X-ray absorption near edge structure

المؤلفون: Toffoli, Daniele, Bernes, Elisa, Cossaro, Albano, Balducci, Gabriele, Stener, Mauro, Mauri, Silvia, Fronzoni, Giovanna

المساهمون: Toffoli, Daniele, Bernes, Elisa, Cossaro, Albano, Balducci, Gabriele, Stener, Mauro, Mauri, Silvia, Fronzoni, Giovanna

مصطلحات موضوعية: DFT calculation, X-ray absorption spectroscopy, boroxine network

Relation: info:eu-repo/semantics/altIdentifier/pmid/35564319; info:eu-repo/semantics/altIdentifier/wos/WOS:000795467900001; volume:12/2022; issue:9; firstpage:1; lastpage:13; numberofpages:13; journal:NANOMATERIALS; https://hdl.handle.net/11368/3030767; info:eu-repo/semantics/altIdentifier/scopus/2-s2.0-85129604273; https://www.mdpi.com/2079-4991/12/9/1610

الاتاحة: https://hdl.handle.net/11368/3030767
https://doi.org/10.3390/nano12091610
https://www.mdpi.com/2079-4991/12/9/1610

المؤلفون: Medves, Marco, Fronzoni, Giovanna, Stener, Mauro

المساهمون: Medves, Marco, Fronzoni, Giovanna, Stener, Mauro

مصطلحات موضوعية: TDDFT, density fitting, Density Functional Theory, Algorithms

Relation: info:eu-repo/semantics/altIdentifier/pmid/36069663; info:eu-repo/semantics/altIdentifier/wos/WOS:000850506100001; volume:43; issue:28; firstpage:1923; lastpage:1935; numberofpages:13; journal:JOURNAL OF COMPUTATIONAL CHEMISTRY; https://hdl.handle.net/11368/3030769; info:eu-repo/semantics/altIdentifier/scopus/2-s2.0-85137563617

الاتاحة: https://hdl.handle.net/11368/3030769
https://doi.org/10.1002/jcc.26992
https://onlinelibrary.wiley.com/doi/full/10.1002/jcc.26992

المؤلفون: Toffoli, Daniele, Quarin, Matteo, Fronzoni, Giovanna, Stener, Mauro

المساهمون: Toffoli, Daniele, Quarin, Matteo, Fronzoni, Giovanna, Stener, Mauro

مصطلحات موضوعية: DFT, TDDFT, BODIPY

وصف الملف: STAMPA

Relation: info:eu-repo/semantics/altIdentifier/pmid/36173265; info:eu-repo/semantics/altIdentifier/wos/WOS:000864717700001; volume:126/2022; issue:40; firstpage:7137; lastpage:7146; numberofpages:10; journal:JOURNAL OF PHYSICAL CHEMISTRY. A, MOLECULES, SPECTROSCOPY, KINETICS, ENVIRONMENT, & GENERAL THEORY; https://hdl.handle.net/11368/3038227; info:eu-repo/semantics/altIdentifier/scopus/2-s2.0-85139642904

الاتاحة: https://hdl.handle.net/11368/3038227
https://doi.org/10.1021/acs.jpca.2c04473
https://pubs.acs.org/doi/10.1021/acs.jpca.2c04473

المؤلفون: Lanzilotto, Valeria, Toffoli, Daniele, Bernes, Elisa, Stener, Mauro, Viola, Elisa, Cossaro, Albano, Costantini, Roberto, Grazioli, Cesare, Totani, Roberta, Fronzoni, Giovanna

المساهمون: Universit? degli Studi di Trieste

المصدر: The Journal of Physical Chemistry A ; volume 126, issue 39, page 6870-6881 ; ISSN 1089-5639 1520-5215

الاتاحة: http://dx.doi.org/10.1021/acs.jpca.2c04517
https://pubs.acs.org/doi/pdf/10.1021/acs.jpca.2c04517

المؤلفون: de Groot, Frank M. F., Elnaggar, Hebatalla, Frati, Federica, Wang, Ru-pan, Delgado-Jaime, Mario U., van Veenendaal, Michel, Fernandez-Rodriguez, Javier, Haverkort, Maurits W., Green, Robert J., van der Laan, Gerrit, Kvashnin, Yaroslav, Hariki, Atsushi, Ikeno, Hidekazu, Ramanantoanina, Harry, Daul, Claude, Delley, Bernard, Odelius, Michael, Lundberg, Marcus, Kuhn, Oliver, Bokarev, Sergey, Shirley, Eric, Vinson, John, Gilmore, Keith, Stener, Mauro, Fronzoni, Giovanna, Decleva, Piero, Kruger, Peter, Retegan, Marius, Joly, Yves, Vorwerk, Christian, Draxl, Claudia, Rehr, John, Tanaka, Arata

المصدر: Journal of Electron Spectroscopy and Related Phenomena. 249

مصطلحات موضوعية: X-ray absorption spectroscopy, Density Functional Theory, Quantum chemistry calculations

وصف الملف: electronic

URL الوصول: https://urn.kb.se/resolve?urn=urn:nbn:se:su:diva-195251
https://doi.org/10.1016/j.elspec.2021.147061
https://su.diva-portal.org/smash/get/diva2:1584283/FULLTEXT01.pdf

المؤلفون: Ponzi, Aurora, Bernes, Elisa, Toffoli, Daniele, Fronzoni, Giovanna, Callegari, Carlo, Ciavardini, Alessandra, Di Fraia, Michele, Richter, Robert, Prince, Kevin C., Sa’adeh, Hanan, Devetta, Michele, Faccialà, Davide, Vozzi, Caterina, Avaldi, Lorenzo, Bolognesi, Paola, Castrovilli, Mattea Carmen, Catone, Daniele, Coreno, Marcello, Plekan, Oksana

المساهمون: Ponzi, Aurora, Bernes, Elisa, Toffoli, Daniele, Fronzoni, Giovanna, Callegari, Carlo, Ciavardini, Alessandra, Di Fraia, Michele, Richter, Robert, Prince, Kevin C., Sa’Adeh, Hanan, Devetta, Michele, Faccialà, Davide, Vozzi, Caterina, Avaldi, Lorenzo, Bolognesi, Paola, Castrovilli, Mattea Carmen, Catone, Daniele, Coreno, Marcello, Plekan, Oksana

مصطلحات موضوعية: X-ray absorption near edge spectroscopy, Indole, Time dependant density functional theory, Energy, Chemical calculations

Relation: info:eu-repo/semantics/altIdentifier/pmid/33961434; info:eu-repo/semantics/altIdentifier/wos/WOS:000655618400014; volume:125; issue:19; firstpage:4160; lastpage:4172; numberofpages:13; journal:JOURNAL OF PHYSICAL CHEMISTRY. A, MOLECULES, SPECTROSCOPY, KINETICS, ENVIRONMENT, & GENERAL THEORY; http://hdl.handle.net/11368/2992710; info:eu-repo/semantics/altIdentifier/scopus/2-s2.0-85106364833

الاتاحة: http://hdl.handle.net/11368/2992710
https://doi.org/10.1021/acs.jpca.1c02570

المؤلفون: Toffoli, Daniele, Turco, Elia, Stredansky, Matus, Costantini, Roberto, Dell'Angela, Martina, Floreano, Luca, Goldoni, Andrea, Morgante, Alberto, Kladnik, Gregor, Cvetko, Dean, de Oteyza, Dimas G., Colazzo, Luciano, Mohammed, Mohammed S. G., Sala, Alessandro, Comelli, Giovanni, Africh, Cristina, Fronzoni, Giovanna, Balducci, Gabriele, Stener, Mauro, Ustunel, Hande

المصدر: Chemistry - A European Journal; Aug2024, Vol. 30 Issue 47, p1-6, 6p

مصطلحات موضوعية: NAPHTHALENE, MOLECULES, ELECTRONS, ATOMS, GOLD

المؤلفون: D'Antoni, Pierpaolo, Toffoli, Daniele, Fronzoni, Giovanna, Stener, Mauro, Sementa, Luca, Fortunelli, Alessandro

المصدر: Journal of Computational Chemistry; Jul2024, Vol. 45 Issue 19, p1657-1666, 10p

مصطلحات موضوعية: NANOWIRES, DICHROISM, TIME-dependent density functional theory, PLASMONICS, SILVER alloys, CIRCULAR dichroism, SILVER

المؤلفون: Toffoli, Daniele, Costantini, Roberto, Bernes, Elisa, Di Nardi, Lorys, Balducci, Gabriele, Viola, Elisa, Fronzoni, Giovanna, Cossaro, Albano, Lanzilotto, Valeria

المصدر: Chemistry – A European Journal ; ISSN 0947-6539 1521-3765

الاتاحة: https://doi.org/10.1002/chem.202403782

المؤلفون: Fronzoni, Giovanna, Cossaro, Albano, Costantini, Roberto, Di Nardi, Lorys, Viola, Elisa, Balducci, Gabriele, Lanzilotto, Valeria, Toffoli, Daniele

المصدر: Applied Surface Science ; volume 642, page 158573 ; ISSN 0169-4332

الاتاحة: http://dx.doi.org/10.1016/j.apsusc.2023.158573
https://api.elsevier.com/content/article/PII:S0169433223022535?httpAccept=text/xml
https://api.elsevier.com/content/article/PII:S0169433223022535?httpAccept=text/plain

المؤلفون: Danielis, Nicola, Vega Dominguez, Lorena, Fronzoni, Giovanna, Stener, Mauro, Bruix, Albert, Neyman, Konstantin M.

المصدر: Articles publicats en revistes (Ciència dels Materials i Química Física)

مصطلحات موضوعية: Energia, Or, Pal·ladi (Element químic), Energy, Gold, Palladium

وصف الملف: 13 p.; application/pdf

Relation: Reproducció del document publicat a: https://doi.org/10.1021/acs.jpcc.1c04222; Journal of Physical Chemistry C, 2021, vol. 125, p. 17372-17384; https://doi.org/10.1021/acs.jpcc.1c04222; http://hdl.handle.net/2445/188420; 714077

الاتاحة: http://hdl.handle.net/2445/188420

المؤلفون: Costantini, Roberto, Toffoli, Hande, Feng, Zhijing, Stredansky, Matus, Toffoli, Daniele, Fronzoni, Giovanna, Dri, Carlo, Comelli, Giovanni, Cvetko, Dean, Kladnik, Gregor, Bavdek, Gregor, Floreano, Luca, Morgante, Alberto, Cossaro, Albano

Relation: Costantini R., TOFFOLİ H., Feng Z., Stredansky M., Toffoli D., Fronzoni G., Dri C., Comelli G., Cvetko D., Kladnik G., et al., "Methylamine terminated molecules on Ni(111): A path to low temperature synthesis of nitrogen-doped graphene", FLATCHEM, cilt.24, 2020; 85093930364; https://hdl.handle.net/11511/70193; 24; WOS:000600414100002

الاتاحة: https://hdl.handle.net/11511/70193
https://doi.org/10.1016/j.flatc.2020.100205

المؤلفون: Chang, Le, Baseggio, Oscar, Sementa, Luca, Cheng, Daojian, Fronzoni, Giovanna, Toffoli, Daniele, Aprà, Edoardo, Stener, Mauro, Fortunelli, Alessandro

المساهمون: Chang, Le, Baseggio, Oscar, Sementa, Luca, Cheng, Daojian, Fronzoni, Giovanna, Toffoli, Daniele, Aprà, Edoardo, Stener, Mauro, Fortunelli, Alessandro

مصطلحات موضوعية: Computer Science Applications1707 Computer Vision and Pattern Recognition, Physical and Theoretical Chemistry

وصف الملف: STAMPA

Relation: info:eu-repo/semantics/altIdentifier/pmid/29897750; info:eu-repo/semantics/altIdentifier/wos/WOS:000438654500029; volume:14; issue:7; firstpage:3703; lastpage:3714; numberofpages:12; journal:JOURNAL OF CHEMICAL THEORY AND COMPUTATION; http://hdl.handle.net/11368/2931100; info:eu-repo/semantics/altIdentifier/scopus/2-s2.0-85048719719

الاتاحة: http://hdl.handle.net/11368/2931100
https://doi.org/10.1021/acs.jctc.8b00250
https://pubs.acs.org/doi/10.1021/acs.jctc.8b00250

المؤلفون: Medves, Marco, Sementa, Luca, Toffoli, Daniele, Fronzoni, Giovanna, Krishnadas, Kumaranchira Ramankutty, Bürgi, Thomas, Bonacchi, Sara, Dainese, Tiziano, Maran, Flavio, Fortunelli, Alessandro, Stener, Mauro

المصدر: Journal of Chemical Physics; 8/28/20221, Vol. 155 Issue 8, p1-12, 12p

مصطلحات موضوعية: LIGHT absorption, LOW temperatures, FUNCTIONALS, GEOMETRY, EQUATIONS

المؤلفون: TOFFOLI, DANIELE, STREDANSKY, MATUS, FENG, ZHIJING, BALDUCCI, GABRIELE, FURLAN, SARA, STENER, MAURO, CVETKO, DEAN, KLADNIK, GREGOR, MORGANTE, ALBERTO, DRI, CARLO, COMELLI, GIOVANNI, FRONZONI, GIOVANNA, Ustunel, Hande, Verdini, Alberto, Cossaro, Albano

المساهمون: Toffoli, Daniele, Stredansky, Matu, Feng, Zhijing, Balducci, Gabriele, Furlan, Sara, Stener, Mauro, Ustunel, Hande, Cvetko, Dean, Kladnik, Gregor, Morgante, Alberto, Verdini, Alberto, Dri, Carlo, Comelli, Giovanni, Fronzoni, Giovanna, Cossaro, Albano

مصطلحات موضوعية: DFT

Relation: info:eu-repo/semantics/altIdentifier/pmid/28580111; info:eu-repo/semantics/altIdentifier/wos/WOS:000400553000058; volume:8; issue:5; firstpage:3789; lastpage:3798; numberofpages:10; journal:CHEMICAL SCIENCE; http://hdl.handle.net/11368/2901591; info:eu-repo/semantics/altIdentifier/scopus/2-s2.0-85021657283; http://pubs.rsc.org/en/Content/ArticleLanding/2017/SC/C6SC05632F

الاتاحة: http://hdl.handle.net/11368/2901591
https://doi.org/10.1039/C6SC05632F
http://pubs.rsc.org/en/Content/ArticleLanding/2017/SC/C6SC05632F