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M

Michele Casula

Sorbonne Université

29H指数
140论文数
2.9K被引数
收录论文 62
发表时间
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Self-Consistency Error Correction for Accurate Machine Learning Potentials from Variational Monte Carlo变分蒙特卡洛方法中准确机器学习势函数的自洽性误差校正
errJournal of Chemical Theory and Computation
IF5.5
err2025-09-24
err0
PREAI
errGiacomo Tenti; Kousuke Nakano; Michele Casula
err分享
err收藏
Synthesis of Machine Learning-Predicted Cs2PbSnI6 Double Perovskite Nanocrystals机器学习预测的Cs2PbSnI6双钙钛矿纳米晶的合成
errACS NANO
IF16
err2025-02-06
err0
PREAI
errMishra, P; Zhang, MY; Kar, M; Hellgren, M; Casula, M; Lenz, B; Chen, AP; Recatala-Gomez, J; Padhy, SP; Trouche, MC; Amara, MR; Cheong, IV; Xing, ZS; Diederichs, C; Sum, TC; Duchamp, M; Lam, YM; Hippalgaonkar, K
err分享
err收藏
Assessing many-body methods on the potential energy surface of the (H2)2 hydrogen dimer
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2024-11-11
err0
errOAAI
errContant, Damian; Casula, Michele; Hellgren, Maria
err分享
err收藏
Quantum effects in H-bond symmetrization and in thermodynamic properties of high pressure ice
errPHYSICAL REVIEW B
IF3.7
err2024-07-29
err2
errOAAI
errCherubini, Marco; Monacelli, Lorenzo; Yang, Bingjia; Car, Roberto; Casula, Michele; Mauri, Francesco
err分享
err收藏
Principal deuterium Hugoniot via quantum Monte Carlo and A-learning
errPHYSICAL REVIEW B
IF3.7
err2024-07-01
err1
PREAI
errTenti, Giacomo; Nakano, Kousuke; Tirelli, Andrea; Sorella, Sandro; Casula, Michele
err分享
err收藏
Efficient calculation of unbiased atomic forces in ab initio variational Monte Carlo
errPHYSICAL REVIEW B
IF3.7
err2024-05-28
err2
errOAAI
errNakano, Kousuke; Casula, Michele; Tenti, Giacomo
err分享
err收藏
Rich phase diagram of the prototypical iridate Ba 2 IrO 4: Effective low-energy models and metal-insulator transition
errPHYSICAL REVIEW B
IF3.7
err2024-04-05
err0
errOAAI
errCassol, Francesco; Gaspard, Leo; Casula, Michele; Martins, Cyril; Lenz, Benjamin
err分享
err收藏
Quantum symmetrization transition in superconducting sulfur hydride from quantum Monte Carlo and path integral molecular dynamics
errNPJ COMPUTATIONAL MATERIALS
IF11.9
err2024-03-15
err1
errOAAI
errTaureau, Romain; Cherubini, Marco; Morresi, Tommaso; Casula, Michele
err分享
err收藏
Order from disorder phenomena in BaCoS2
errCOMMUNICATIONS PHYSICS
IF5.8
err2024-01-16
err2
errOAAI
errLenz, Benjamin; Fabrizio, Michele; Casula, Michele
err分享
err收藏
TURBOGENIUS: Python suite for high-throughput calculations of ab initio quantum Monte Carlo methods
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2023-12-11
err3
errOAAI
errNakano, Kousuke; Kohulak, Oto; Raghav, Abhishek; Casula, Michele; Sorella, Sandro
err分享
err收藏
Rényi entropy of a quantum anharmonic chain at nonzero temperature
errPHYSICAL REVIEW B
IF3.7
err2023-12-07
err2
errOAAI
errSrdinsek, Miha; Casula, Michele; Vuilleumier, Rodolphe
err分享
err收藏
Thermal dependence of the hydrated proton and optimal proton transfer in the protonated water hexamer
errNATURE COMMUNICATIONS
IF15.7
err2023-10-30
err3
errOAAI
errMouhat, Felix; Peria, Matteo; Morresi, Tommaso; Vuilleumier, Rodolphe; Saitta, Antonino Marco; Casula, Michele
err分享
err收藏
Quantum phase diagram of high-pressure hydrogen
errNATURE PHYSICS
IF18.4
err2023-03-13
err25
PREAI
errMonacelli, Lorenzo; Casula, Michele; Nakano, Kousuke; Sorella, Sandro; Mauri, Francesco
err分享
err收藏
Manipulating Dirac States in BaNiS2 by Surface Charge Doping
errNANO LETTERS
IF9.1
err2023-01-18
err3
errOAAI
errZhang, Jiuxiang; Sohier, Thibault Daniel Pierre; Casula, Michele; Chen, Zhesheng; Caillaux, Jonathan; Papalazarou, Evangelos; Perfetti, Luca; Petaccia, Luca; Bendounan, Azzedine; Taleb-Ibrahimi, Amina; Santos-Cottin, David; Klein, Yannick; Gauzzi, Andrea; Marsi, Marino
err分享
err收藏
High-pressure II-III phase transition in solid hydrogen: Insights from state-of-the-art ab initio calculations
errPHYSICAL REVIEW RESEARCH
IF4.2
err2022-10-17
err5
errOAAI
errHellgren, Maria; Contant, Damian; Pitts, Thomas; Casula, Michele
err分享
err收藏
Hydrogen phase-IV characterization by full account of quantum anharmonicity
errPHYSICAL REVIEW B
IF3.7
err2022-08-25
err7
errOAAI
errMorresi, Tommaso; Vuilleumier, Rodolphe; Casula, Michele
err分享
err收藏
Quantum Renyi entropy by optimal thermodynamic integration paths
errPHYSICAL REVIEW RESEARCH
IF4.2
err2022-07-05
err3
errOAAI
errSrdinsek, Miha; Casula, Michele; Vuilleumier, Rodolphe
err分享
err收藏
Ground-state properties of the narrowest zigzag graphene nanoribbon from quantum Monte Carlo and comparison with density functional theory
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2022-02-23
err8
errOAAI
errMeena, Raghavendra; Li, Guanna; Casula, Michele
err分享
err收藏
Optical conductivity signatures of open Dirac nodal lines
errPHYSICAL REVIEW B
IF3.7
err2021-11-29
err8
errOAAI
errSantos-Cottin, David; Casula, Michele; de' Medici, Luca; Le Mardele, F.; Wyzula, J.; Orlita, M.; Klein, Yannick; Gauzzi, Andrea; Akrap, Ana; Lobo, R. P. S. M.
err分享
err收藏
Photoinduced Dirac-cone flattening in BaNiS2
errPHYSICAL REVIEW B
IF3.7
err2021-09-20
err6
errOAAI
errBittner, Nikolaj; Golez, Denis; Casula, Michele; Werner, Philipp
err分享
err收藏

研究方向

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