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Paolo Giannozzi

university of udine

44H指数
157论文数
5.1W被引数
收录论文 32
发表时间
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Carbon monoxide ligation at single metal atom sites in a 2D manganese-cobalt coordination network: equilibrium at room temperature一氧化碳在二维锰-钴配位网络中单金属原子位点的配位：室温下的平衡
errj. mater. chem. a
IF0
err2026-03-13
err0
errOAAI
errMichela De Col; Danilo Comini; Stefania Baronio; Basant Roondhe; Alessandro Namar; Davide Bidoggia; Mattia Scardamaglia; Paolo Giannozzi; Erik Vesselli
err分享
err收藏
Pressure-controlled oxygen activation at single metal atom sites in a manganese-cobalt coordination network on graphene: from triplet-singlet spin transition to superoxo dissociation在石墨烯上的锰-钴配位网络中单金属原子位点的压力控制氧活化：从三线态-单线态自旋转变到超氧离解
errNanoscale
IF5.1
err2026-03-11
err0
errOAAI
errAsha Yadav; Stefania Baronio; Michela De Col; Danilo Comini; Valentine Mischke; Alessandro Namar; Nikolay Vinogradov; Mattia Scardamaglia; Mirko Cinchetti; Giovanni Zamborlini; Paolo Giannozzi; Erik Vesselli
err分享
err收藏
Single atom coordination in a manganese–cobalt bi-metallic framework on graphene: geometric and electronic structures石墨烯上锰-钴双金属框架中单原子配位：几何结构与电子结构
errNanoscale
IF5.1
err2025-07-27
err0
errOAAI
errStefania Baronio; Michela De Col; Asha Yadav; Basant Roondhe; Valentin Mischke; Olga Resel; Davide Bidoggia; Alessandro Namar; Nikolay Vinogradov; Mattia Scardamaglia; Manuel Valvidares; Pierluigi Gargiani; Mirko Cinchetti; Giovanni Zamborlini; Paolo Giannozzi; Erik Vesselli
err分享
err收藏
Reactive natural deep eutectic solvents increase selectivity and efficiency of lipase catalyzed esterification of carbohydrate polyols
errCATALYSIS TODAY
IF5.3
err2024-01-01
err19
PREAI
errBuzatu, Alina Ramona; Soler, Miguel Angel; Fortuna, Sara; Ozkilinc, Ozge; Dreava, Diana Maria; Bitcan, Ioan; Badea, Valentin; Giannozzi, Paolo; Fogolari, Federico; Gardossi, Lucia; Peter, Francisc; Todea, Anamaria; Boeriu, Carmen Gabriela
err分享
err收藏
Lipase-catalysed esterification in a reactive natural deep eutectic solvent leads to lauroylcholine chloride rather than glucose ester
errREACTION CHEMISTRY & ENGINEERING
IF3.1
err2024-01-01
err3
errOAAI
errBuzatu, Alina Ramona; Soler, Miguel Angel; Ozkilinc, Ozge; Fortuna, Sara; Dreava, Diana Maria; Bitcan, Ioan; Giannozzi, Paolo; Fogolari, Federico; Gardossi, Lucia; Peter, Francisc; Todea, Anamaria; Boeriu, Carmen Gabriela
err分享
err收藏
Quantum ESPRESSO: One Further Step toward the Exascale
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2023-07-31
err37
errOAAI
errCarnimeo, Ivan; Affinito, Fabio; Baroni, Stefano; Baseggio, Oscar; Bellentani, Laura; Bertossa, Riccardo; Delugas, Pietro Davide; Ruffino, Fabrizio Ferrari; Orlandini, Sergio; Spiga, Filippo; Giannozzi, Paolo
err分享
err收藏
Molecular electrostatics and pKa shifts calculations with the Generalized Born model. A tutorial through examples with Bluues2
errCOMPUTER PHYSICS COMMUNICATIONS
IF3.4
err2023-06-01
err3
errOAAI
errSoler, Miguel Angel; Ozkilinc, Ozge; Hunashal, Yamanappa; Giannozzi, Paolo; Esposito, Gennaro; Fogolari, Federico
err分享
err收藏
Measuring Shared Electrons in Extended Molecular Systems: Covalent Bonds from Plane-Wave Representation of Wave Function
errMOLECULES
IF4.6
err2021-07-01
err1
errOAAI
errLa Penna, Giovanni; Tiana, Davide; Giannozzi, Paolo
err分享
err收藏
Unit cell restricted Bloch functions basis for first-principle transport models: Theory and application
errPHYSICAL REVIEW B
IF3.7
err2020-07-08
err21
errOAAI
errPala, M. G.; Giannozzi, I. P.; Esseni, D.
err分享
err收藏
Quantum ESPRESSO toward the exascale迈向exascale的量子浓缩咖啡
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2020-04-17
err1.1K
errOAAI
errGiannozzi, Paolo; Baseggio, Oscar; Bonfa, Pietro; Brunato, Davide; Car, Roberto; Carnimeo, Ivan; Cavazzoni, Carlo; de Gironcoli, Stefano; Delugas, Pietro; Ruffino, Fabrizio Ferrari; Ferretti, Andrea; Marzari, Nicola; Timrov, Iurii; Urru, Andrea; Baroni, Stefano
err分享
err收藏
Photocatalytic and Photovoltaic Properties of TiO2 Nanoparticles Investigated by Ab Initio Simulations
errJOURNAL OF PHYSICAL CHEMISTRY C
IF3.2
err2014-12-15
err27
PREAI
errMattioli, Giuseppe; Bonapasta, Aldo Amore; Bovi, Daniele; Giannozzi, Paolo
err分享
err收藏
Positional disorder in ammonia borane at ambient conditions
errPHYSICAL REVIEW B
IF3.7
err2014-05-21
err5
errOAAI
errWelchman, E.; Giannozzi, P.; Thonhauser, T.
err分享
err收藏
Interfacial Engineering of P3HT/ZnO Hybrid Solar Cells Using Phthalocyanines: A Joint Theoretical and Experimental Investigation
errADVANCED ENERGY MATERIALS
IF26
err2014-04-22
err39
PREAI
errMattioli, Giuseppe; Ben Dkhil, Sadok; Saba, Maria Ilenia; Malloci, Giuliano; Melis, Claudio; Alippi, Paola; Filippone, Francesco; Giannozzi, Paolo; Thakur, Anil Kumar; Gaceur, Meriem; Margeat, Olivier; Diallo, Abdou Karim; Videlot-Ackermann, Christine; Ackermann, Joerg; Bonapasta, Aldo Amore; Mattoni, Alessandro
err分享
err收藏
Reaction Pathways for Oxygen Evolution Promoted by Cobalt Catalyst钴催化剂促进析氧的反应途径
errJOURNAL OF THE AMERICAN CHEMICAL SOCIETY
IF15.6
err2013-10-03
err236
errOAAI
errMattioli, Giuseppe; Giannozzi, Paolo; Bonapasta, Aldo Amore; Guidonili, Leonardo
err分享
err收藏
Zinc Oxide-Zinc Phthalocyanine interface for Hybrid Solar Cells
errJOURNAL OF PHYSICAL CHEMISTRY C
IF3.2
err2012-07-18
err39
PREAI
errMattioli, Giuseppe; Melis, Claudio; Malloci, Giuliano; Filippone, Francesco; Alippi, Paola; Giannozzi, Paolo; Mattoni, Alessandro; Bonapasta, Aldo Amore
err分享
err收藏
Core-level shift analysis of amorphous CdTeO x materials
errJOURNAL OF MATERIALS SCIENCE
IF3.9
err2010-03-30
err6
PREAI
errLizarraga, R.; Holmstroem, E.; Amezaga, A.; Bock, N.; Peery, T.; Menendez-Proupin, E.; Giannozzi, P.
err分享
err收藏
Quantitative local environment characterization in amorphous oxides
errPHYSICAL REVIEW B
IF3.7
err2010-01-27
err16
PREAI
errAmezaga, Alexis; Holmstroem, Erik; Lizarraga, Raquel; Menendez-Proupin, Eduardo; Bartolo-Perez, P.; Giannozzi, Paolo
err分享
err收藏
Gas adsorption on graphene doped with B, N, Al, and S: A theoretical study
errAPPLIED PHYSICS LETTERS
IF3.6
err2009-12-08
err669
PREAI
errDai, Jiayu; Yuan, Jianmin; Giannozzi, Paolo
err分享
err收藏
Ab initio Theoretical Investigation of Phthalocyanine-Semiconductor Hybrid Systems
errCHEMISTRY OF MATERIALS
IF7
err2009-09-16
err29
PREAI
errMattioli, G.; Filippone, F.; Giannozzi, P.; Caminiti, R.; Bonapasta, A. Amore
err分享
err收藏
Ab initio molecular dynamics study of amorphous CdTeOx alloys: Structural properties非晶态CdTeOx合金的从头算分子动力学研究: 结构性质
errPHYSICAL REVIEW B
IF3.7
err2009-01-21
err9
PREAI
errMenendez-Proupin, E.; Giannozzi, P.; Peralta, J.; Gutierrez, G.
err分享
err收藏

研究方向

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