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C

Carlo Massobrio

cnrs - institute of chemistry

40H指数
264论文数
5.2K被引数
收录论文 98
发表时间
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Quantitative assessment of the structure of (Na2O)0.1-(V2O5)0.6-(TeO2)0.3 glass: An ab initio and machine learning interatomic potential study of oxide systems with mixed-valence钠氧-五氧化二钒-二氧化碲玻璃（(Na2O)0.1-(V2O5)0.6-(TeO2)0.3）结构的定量评估：一种基于第一性原理和机器学习的混合价态氧化物体系原子间势能研究
errArtificial Intelligence Chemistry
IF0
err2026-06-01
err0
errOAAI
errShuaib, Firas; Piotrowski, Remi; Delaizir, Gaelle; Geffroy, Pierre-Marie; Wendji, Steve Dave Wansi; Massobrio, Carlo; Boero, Mauro; Ori, Guido; Thomas, Philippe; Masson, Olivier; Bouzid, Assil
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Elaboration and Characterizations of Glasses/Glass-Ceramics in the Na2O-V2O5-TeO2 System for Energy Storage ApplicationsNa2O-V2O5-TeO2体系中用于储能应用的玻璃/玻璃陶瓷的制备与表征
errInternational Journal of Applied Glass Science
IF2.5
err2026-05-20
err0
PREAI
errPiotrowski, Remi; Laval, Jean-Paul; Geffroy, Pierre-Marie; Masson, Olivier; Laborde, Etienne; Shuaib, Firas; Bouzid, Assil; Thomas, Philippe; Wendji, Steve Dave Wansi; Boero, Mauro; Massobrio, Carlo; Ori, Guido; Dolle, Mickael; Chartrand, Daniel; Genevois, Cecile; Delaizir, Gaelle
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Intermediate Range Order in Liquid GeSe2: Known Facts and Elusive Issues Revisited by Combining First-Principles and Million Atoms Machine-Learning Calculations液态GeSe2中的中间范围有序性：结合第一性原理和百万原子机器学习计算对已知事实和模糊问题的重新审视
errThe Journal of Physical Chemistry Letters
IF0
err2026-04-09
err0
PREAI
errSteve Dave Wansi Wendji; Carlo Massobrio; Mauro Boero; Assil Bouzid; Cheick Oumar Diarra; Antonio Familiari; Mohammed Guerboub; Wissal Jnah; Achille Lambrecht; Evelyne Martin; Louis Petit; Julien Taillieu; Guido Ori
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On the crystallization tendency of amorphous Sb 2S 3 under pressure: A first-principles molecular dynamics study在压力下非晶Sb₂S₃的结晶趋势：一项第一性原理分子动力学研究
errSolid State Sciences
IF3.3
err2026-04-08
err0
errOAAI
errLouis Petit; Julien Taillieu; Carlo Massobrio; Cheick O. Diarra; Achille Lambrecht; Mauro Boero; Evelyne Martin
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Heat transfer through covalent versus non-covalent bonding: a case study in the crystalline π-conjugated P3HT polymer by approach-to-equilibrium molecular dynamics通过共价键与非共价键的热传递：在结晶型π共轭P3HT聚合物中的平衡趋近分子动力学案例研究
errPhys. Chem. Chem. Phys.
IF2.9
err2025-08-11
err0
errOAAI
errCheick Oumar DIARRA; Carlo Massobrio; Evelyne Martin
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Enhanced structural description of sodium vanadium phosphate glasses: A combined experimental and molecular dynamics study磷酸钒钠玻璃的增强结构描述: 结合实验和分子动力学研究
errJOURNAL OF NON-CRYSTALLINE SOLIDS
IF3.5
err2025-05-01
err0
PREAI
errWendji, S. D. Wansi; Piotrowski, R.; Massobrio, C.; Boero, M.; Tugene, C.; Shuaib, F.; Hamani, D.; Geffroy, P. -m.; Thomas, P.; Bouzid, A.; Masson, O.; Delaizir, G.; Ori, G.
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Amorphous structures and statistical sampling in first-principles molecular dynamics: The prototypical case of glassy GeSe3
errJOURNAL OF NON-CRYSTALLINE SOLIDS
IF3.5
err2025-04-01
err0
errOAAI
errMartin, Evelyne; Massobrio, Carlo
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Quantitative assessment of the structure and bonding properties of 50VxOy-50P2O5 glass by classical and Born-Oppenheimer molecular dynamics通过经典和born-oppenheimer分子动力学对50VxOy-50P2O5玻璃的结构和键合性能进行定量评估
errJOURNAL OF NON-CRYSTALLINE SOLIDS
IF3.5
err2024-06-01
err1
PREAI
errWendji, S. D. Wansi; Massobrio, C.; Boero, M.; Tugene, C.; Levchenko, E.; Shuaib, F.; Piotrowski, R.; Hamani, D.; Delaizir, G.; Geffroy, P. -M.; Thomas, P.; Masson, O.; Bouzid, A.; Ori, G.
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Thermal conductivity of crystalline Ge2Sb2Te5: lattice contribution and size effects in the cubic phase quantified by approach-to-equilibrium molecular dynamics
errJOURNAL OF PHYSICS D-APPLIED PHYSICS
IF3.2
err2024-03-19
err0
errOAAI
errBel-Hadj, Ibrahim; Guerboub, Mohammed; Lambrecht, Achille; Ori, Guido; Massobrio, Carlo; Martin, Evelyne
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Assessing the thermal conductivity of amorphous SiN by approach-to-equilibrium molecular dynamics
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2024-03-05
err0
errOAAI
errLambrecht, Achille; Ori, Guido; Massobrio, Carlo; Boero, Mauro; Martin, Evelyne
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Structural-Stability Study of Antiperovskite Na3OCl for Na-Rich Solid Electrolyte
errPHYSICAL REVIEW APPLIED
IF4.4
err2023-03-01
err6
errOAAI
errPham, Tan -Lien; Choi, Woon Ih; Shafique, Aamir; Kim, Hye Jung; Shim, Munbo; Min, Kyoungmin; Son, Won-Joon; Jang, Inkook; Kim, Dae Sin; Boero, Mauro; Massobrio, Carlo; Ori, Guido; Lee, Hyo Sug; Shin, Young -Han
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Impact of the local atomic structure on the thermal conductivity of amorphous Ge2Sb2Te5
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2023-02-24
err4
errOAAI
errGuerboub, Mohammed; Wansi Wendji, Steve Dave; Massobrio, Carlo; Bouzid, Assil; Boero, Mauro; Ori, Guido; Martin, Evelyne
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Unveiling the structure and ion dynamics of amorphous Na3-xOHxCl antiperovskite electrolytes by first-principles molecular dynamics
errJOURNAL OF MATERIALS CHEMISTRY A
IF9.5
err2023-01-01
err4
errOAAI
errPham, Tan-Lien; Guerboub, Mohammed; Bouzid, Assil; Boero, Mauro; Massobrio, Carlo; Shin, Young-Han; Ori, Guido
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Impact of Dispersion Force Schemes on Liquid Systems: Comparing Efficiency and Drawbacks for Well-Targeted Test Cases
errMOLECULES
IF4.6
err2022-12-18
err2
errOAAI
errMartin, Evelyne; Amiehe Essomba, Irene Berenger; Ishisone, Kana; Boero, Mauro; Ori, Guido; Massobrio, Carlo
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Atomic structure of amorphous SiN: Combining Car-Parrinello and Born-Oppenheimer first-principles molecular dynamics
errCOMPUTATIONAL MATERIALS SCIENCE
IF3.3
err2022-08-01
err3
errOAAI
errLambrecht, Achille; Massobrio, Carlo; Boero, Mauro; Ori, Guido; Martin, Evelyne
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Quantitative assessment of the structure of Ge20Te73I7 chalcohalide glass by first-principles molecular dynamics
errPHYSICAL REVIEW B
IF3.7
err2021-03-29
err6
errOAAI
errBouzid, Assil; Pham, Tan-Lien; Chaker, Ziyad; Boero, Mauro; Massobrio, Carlo; Shin, Young-Han; Ori, Guido
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Challenges and opportunities of atomistic simulations for glass and amorphous materials
errJOURNAL OF NON-CRYSTALLINE SOLIDS
IF3.5
err2020-11-01
err0
PREAI
errDu, Jincheng; Rino, Jose Pedro; Massobrio, Carlo; Cormack, Alastair N.
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Thermal resistance of an interfacial molecular layer by first-principles molecular dynamics
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2020-08-18
err8
errOAAI
errThuy-Quynh Duong; Massobrio, Carlo; Ori, Guido; Boero, Mauro; Martin, Evelyne
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Heat transport in disordered network forming materials: Size effects and existence of propagative modes
errCOMPUTATIONAL MATERIALS SCIENCE
IF3.3
err2020-05-01
err4
errOAAI
errThuy-Quynh Duong; Massobrio, Carlo; Boero, Mauro; Ori, Guido; Martin, Evelyne
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Chalcogenide glasses for innovation in applied science: fundamental issues and new insights
errJOURNAL OF PHYSICS D-APPLIED PHYSICS
IF3.2
err2019-10-24
err2
errOAAI
errMassobrio, Carlo; Bouzid, Assil; Boero, Mauro; Ori, Guido; Martin, Evelyne; Le Roux, Sebastien
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研究方向

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