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Giovanni Granucci

dipartimento di chimica e chimica industriale, via moruzzi 13, 56124 pisa, italy

37H指数
147论文数
7.0K被引数
收录论文 51
发表时间
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A Density Functional Theory and Semiempirical Framework for Trajectory Surface Hopping on Extended Systems一种用于扩展系统轨迹曲面跳跃的密度泛函理论及半经验框架
errJournal of Chemical Theory and Computation
IF5.5
err2025-10-17
err0
errOAAI
errJan-Robert Vogt; Michael Schulz; Rafael Souza Mattos; Mario Barbatti; Maurizio Persico; Giovanni Granucci; Jürg Hutter; Anna Hehn
err分享
err收藏
Roadmap for Molecular Benchmarks in Nonadiabatic Dynamics非绝热动力学中分子基准的研究路线图
errThe Journal of Physical Chemistry A
IF0
err2025-07-15
err0
errOAAI
errLéon L. E. Cigrang; Basile F. E. Curchod; Rebecca A. Ingle; Aaron Kelly; Jonathan R. Mannouch; Davide Accomasso; Alexander Alijah; Mario Barbatti; Wiem Chebbi; Nadja Došlić; Elliot C. Eklund; Sebastian Fernandez-Alberti; Antonia Freibert; Leticia González; Giovanni Granucci; Federico J. Hernández; Javier Hernández-Rodríguez; Amber Jain; Jiří Janoš; Ivan Kassal; Adam Kirrander; Zhenggang Lan; Henrik R. Larsson; David Lauvergnat; Brieuc Le Dé; Yeha Lee; Neepa T. Maitra; Seung Kyu Min; Daniel Peláez; David Picconi; Zixing Qiu; Umberto Raucci; Patrick Robertson; Eduarda Sangiogo Gil; Marin Sapunar; Peter Schürger; Patrick Sinnott; Sergei Tretiak; Arkin Tikku; Patricia Vindel-Zandbergen; Graham A. Worth; Federica Agostini; Sandra Gómez; Lea M. Ibele; Antonio Prlj
err分享
err收藏
Excitonic Approach for Nonadiabatic Dynamics: Extending Beyond the Frenkel Exciton Model
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2024-09-16
err2
PREAI
errGil, Eduarda Sangiogo; Giustini, Andrea; Accomasso, Davide; Granucci, Giovanni
err分享
err收藏
An algorithm for very high pressure molecular dynamics simulations超高压分子动力学模拟的一种算法
errJOURNAL OF COMPUTATIONAL CHEMISTRY
IF4.8
err2024-08-29
err0
errOAAI
errTesi, Marina; Cammi, Roberto; Granucci, Giovanni; Persico, Maurizio
err分享
err收藏
Investigating the Photodynamics of trans-Azobenzene with Coupled Trajectories
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2024-01-04
err11
errOAAI
errPieroni, Carlotta; Gil, Eduarda Sangiogo; Ibele, Lea M.; Persico, Maurizio; Granucci, Giovanni; Agostini, Federica
err分享
err收藏
Computational design of covalently bound dimers for singlet fission
errJOURNAL OF PHOTOCHEMISTRY AND PHOTOBIOLOGY A-CHEMISTRY
IF4.7
err2023-09-01
err0
errOAAI
errAccomasso, Davide; Amor, Nadia Ben; Persico, Maurizio; Granucci, Giovanni
err分享
err收藏
Effect of Initial Conditions Sampling on Surface Hopping Simulations in the Ultrashort and Picosecond Time Range. Azomethane Photodissociation as a Case Study
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2023-04-18
err20
PREAI
errPieroni, Carlotta; Becuzzi, Filippo; Creatini, Luigi; Granucci, Giovanni; Persico, Maurizio
err分享
err收藏
The radiative surface hopping (RSH) algorithm: Capturing fluorescence events in molecular systems within a semi-classical non-adiabatic molecular dynamics framework
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2023-03-22
err6
errOAAI
errPerez-Escribano, Manuel; Jankowska, Joanna; Granucci, Giovanni; Escudero, Daniel
err分享
err收藏
Dual photoisomerization mechanism of azobenzene embedded in a lipid membrane
errJOURNAL OF MATERIALS CHEMISTRY B
IF5.7
err2023-01-01
err8
errOAAI
errOsella, Silvio; Granucci, Giovanni; Persico, Maurizio; Knippenberg, Stefan
err分享
err收藏
Protein control of photochemistry and transient intermediates in phytochromes植物色素中的光化学和瞬态中间体的蛋白质控制
errNATURE COMMUNICATIONS
IF15.7
err2022-11-11
err22
errOAAI
errSalvadori, Giacomo; Macaluso, Veronica; Pellicci, Giulia; Cupellini, Lorenzo; Granucci, Giovanni; Mennucci, Benedetta
err分享
err收藏
Frenkel exciton photodynamics of self-assembled monolayers of azobiphenyls
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2022-10-24
err10
PREAI
errGil, Eduarda Sangiogo; Persico, Maurizio; Granucci, Giovanni
err分享
err收藏
Newton-X Platform: New Software Developments for Surface Hopping and Nuclear EnsemblesNewton-x平台: 用于表面跳跃和核合奏的新软件开发
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2022-10-04
err55
errOAAI
errBarbatti, Mario; Bondanza, Mattia; Crespo-Otero, Rachel; Demoulin, Baptiste; Dral, Pavlo O.; Granucci, Giovanni; Kossoski, Fabris; Lischka, Hans; Mennucci, Benedetta; Mukherjee, Saikat; Pederzoli, Marek; Persico, Maurizio; Pinheiro, Max; Pittner, Jiri; Plasser, Felix; Gil, Eduarda Sangiogo; Stojanovic, Ljiljana
err分享
err收藏
Computational design of singlet fission biradicaloid chromophores
errJOURNAL OF PHOTOCHEMISTRY AND PHOTOBIOLOGY A-CHEMISTRY
IF4.7
err2022-05-01
err5
PREAI
errAccomasso, Davide; Persico, Maurizio; Granucci, Giovanni
err分享
err收藏
Surface Hopping Dynamics with the Frenkel Exciton Model in a Semiempirical Framework
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2021-11-29
err20
errOAAI
errGil, Eduarda Sangiogo; Granucci, Giovanni; Persico, Maurizio
err分享
err收藏
Multiscale Models for Light-Driven Processes
errANNUAL REVIEW OF PHYSICAL CHEMISTRY
IF0
err2021-04-20
err31
errOAAI
errNottoli, Michele; Cupellini, Lorenzo; Lipparini, Filippo; Granucci, Giovanni; Mennucci, Benedetta
err分享
err收藏
Photoisomerization dynamics of spiropyran: A surface-hopping investigation
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2021-03-29
err5
PREAI
errGranucci, Giovanni; Padula, Giancarlo
err分享
err收藏
Sampling initial positions and momenta for nuclear trajectories from quantum mechanical distributions
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2021-02-19
err8
PREAI
errYao, Yuxuan; Hase, William L.; Granucci, Giovanni; Persico, Maurizio
err分享
err收藏
Singlet fission in covalent dimers of methylene-locked 1,3-diphenyl-isobenzofuran: semiclassical simulations of nonadiabatic dynamics
errJOURNAL OF MATERIALS CHEMISTRY A
IF9.5
err2021-01-01
err7
PREAI
errAccomasso, Davide; Granucci, Giovanni; Persico, Maurizio
err分享
err收藏
Surface Hopping Dynamics for Azobenzene Photoisomerization: Effects of Packing Density on Surfaces, Fluorination, and Excitation Wavelength
errJOURNAL OF PHYSICAL CHEMISTRY C
IF3.2
err2020-11-19
err11
PREAI
errRietze, Clemens; Titov, Evgenii; Granucci, Giovanni; Saalfrank, Peter
err分享
err收藏
Photochemistry in the strong coupling regime: A trajectory surface hopping scheme
errJOURNAL OF COMPUTATIONAL CHEMISTRY
IF4.8
err2020-07-01
err32
errOAAI
errFregoni, Jacopo; Corni, Stefano; Persico, Maurizio; Granucci, Giovanni
err分享
err收藏

研究方向

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合作学者
合作期刊
J
James T. Hynes
H 指数: 97 · 论文数: 423
S
Sergei Tretiak
H 指数: 88 · 论文数: 738
B
Benedetta Mennucci
H 指数: 84 · 论文数: 566
J
John C. Tully
H 指数: 82 · 论文数: 272
W
William L. Hase
H 指数: 74 · 论文数: 510
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