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Federico Grasselli

dipartimento di scienze fisiche, informatiche e matematiche, università degli studi di modena e reggio emilia, 41125 modena, italy

13H指数
64论文数
459被引数
收录论文 24
发表时间
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Uncertainty in the era of machine learning for atomistic modeling机器学习时代原子建模中的不确定性
errDigital Discovery
IF5.6
err2025-09-07
err0
errOAAI
errFederico Grasselli; Sanggyu Chong; Venkat Kapil; Silvia Bonfanti; Kevin Rossi
err分享
err收藏
Transport coefficients from equilibrium molecular dynamics平衡分子动力学的输运系数
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2025-02-13
err0
errOAAI
errPegolo, Paolo; Drigo, Enrico; Grasselli, Federico; Baroni, Stefano
err分享
err收藏
Adaptive energy reference for machine-learning models of the electronic density of states电子态密度机器学习模型的自适应能量参考
errPHYSICAL REVIEW MATERIALS
IF3.4
err2025-01-22
err0
PREAI
errBin How, Wei; Chong, Sanggyu; Grasselli, Federico; Huguenin-Dumittan, Kevin K.; Ceriotti, Michele
err分享
err收藏
Prediction rigidities for data-driven chemistry
errFARADAY DISCUSSIONS
IF3.1
err2025-01-01
err0
errOAAI
errChong, Sanggyu; Bigi, Filippo; Grasselli, Federico; Loche, Philip; Kellner, Matthias; Ceriotti, Michele
err分享
err收藏
A prediction rigidity formalism for low-cost uncertainties in trained neural networks
errMACHINE LEARNING-SCIENCE AND TECHNOLOGY
IF4.6
err2024-10-22
err0
errOAAI
errBigi, Filippo; Chong, Sanggyu; Ceriotti, Michele; Grasselli, Federico
err分享
err收藏
Thermal conductivity of Li 3 PS 4 solid electrolytes with ab initio accuracyLi 3 PS 4固体电解质的热导率
errPHYSICAL REVIEW MATERIALS
IF3.4
err2024-06-12
err1
PREAI
errTisi, Davide; Grasselli, Federico; Gigli, Lorenzo; Ceriotti, Michele
err分享
err收藏
Mechanism of Charge Transport in Lithium Thiophosphate硫代磷酸锂的电荷传输机理
errCHEMISTRY OF MATERIALS
IF7
err2024-02-05
err8
errOAAI
errGigli, Lorenzo; Tisi, Davide; Grasselli, Federico; Ceriotti, Michele
err分享
err收藏
Robustness of Local Predictions in Atomistic Machine Learning Models原子机器学习模型中局部预测的鲁棒性
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2023-11-10
err18
errOAAI
errChong, Sanggyu; Grasselli, Federico; Ben Mahmoud, Chiheb; Morrow, Joe D.; Deringer, Volker L.; Ceriotti, Michele
err分享
err收藏
Self-interaction and transport of solvated electrons in molten salts
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2023-09-07
err4
PREAI
errPegolo, Paolo; Baroni, Stefano; Grasselli, Federico
err分享
err收藏
Effect of a temperature gradient on the screening properties of ionic fluids
errPHYSICAL REVIEW MATERIALS
IF3.4
err2023-04-27
err3
errOAAI
errGrisafi, Andrea; Grasselli, Federico
err分享
err收藏
Predicting hot-electron free energies from ground-state data
errPHYSICAL REVIEW B
IF3.7
err2022-09-27
err5
errOAAI
errBen Mahmoud, Chiheb; Grasselli, Federico; Ceriotti, Michele
err分享
err收藏
Investigating finite-size effects in molecular dynamics simulations of ion diffusion, heat transport, and thermal motion in superionic materials
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2022-04-06
err21
errOAAI
errGrasselli, Federico
err分享
err收藏
Temperature- and vacancy-concentration-dependence of heat transport in Li3ClO from multi-method numerical simulations
errNPJ COMPUTATIONAL MATERIALS
IF11.9
err2022-01-28
err24
errOAAI
errPegolo, Paolo; Baroni, Stefano; Grasselli, Federico
err分享
err收藏
Thermal and Tidal Evolution of Uranus with a Growing Frozen Core具有不断增长的冻结核心的天王星的热和潮汐演化
errPLANETARY SCIENCE JOURNAL
IF4.3
err2021-11-03
err23
errOAAI
errStixrude, Lars; Baroni, Stefano; Grasselli, Federico
err分享
err收藏
Uncertainty estimation for molecular dynamics and sampling分子动力学和取样的不确定度估计
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2021-02-16
err76
errOAAI
errImbalzano, Giulio; Zhuang, Yongbin; Kapil, Venkat; Rossi, Kevin; Engel, Edgar A.; Grasselli, Federico; Ceriotti, Michele
err分享
err收藏
Oxidation States, Thouless' Pumps, and Nontrivial Ionic Transport in Nonstoichiometric Electrolytes
errPHYSICAL REVIEW X
IF15.7
err2020-11-12
err14
errOAAI
errPegolo, Paolo; Grasselli, Federico; Baroni, Stefano
err分享
err收藏
Heat and charge transport in H2O at ice-giant conditions from ab initio molecular dynamics simulations
errNATURE COMMUNICATIONS
IF15.7
err2020-07-17
err30
errOAAI
errGrasselli, Federico; Stixrude, Lars; Baroni, Stefano
err分享
err收藏
Topological quantization and gauge invariance of charge transport in liquid insulators
errNATURE PHYSICS
IF18.4
err2019-07-01
err27
errOAAI
errGrasselli, Federico; Baroni, Stefano
err分享
err收藏
Classical and quantum dynamics of indirect excitons driven by surface acoustic waves
errPHYSICAL REVIEW B
IF3.7
err2018-10-05
err5
errOAAI
errGrasselli, Federico; Bertoni, Andrea; Goldoni, Guido
err分享
err收藏
The role of internal dynamics in the coherent evolution of indirect excitons
errSUPERLATTICES AND MICROSTRUCTURES
IF3.3
err2017-08-01
err3
PREAI
errGrasselli, Federico; Bertoni, Andrea; Goldoni, Guido
err分享
err收藏

研究方向

暂时未获取到该数据
合作学者
合作期刊
S
Stefano Baroni
H 指数: 69 · 论文数: 378
M
Michele Ceriotti
H 指数: 62 · 论文数: 416
L
Lars Stixrude
H 指数: 61 · 论文数: 380
V
Volker L. Deringer
H 指数: 53 · 论文数: 284
G
Guido Goldoni
H 指数: 26 · 论文数: 158
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