Daniele Fontanari Ingénieur de rechercheExpert en calcul scientifique

Identifiants chercheurs

IdHAL :

danielefontanari

ORCID :

0000-0002-5304-5670

IdRef :

17924941X

VIAF :

313566284

ResearcherID :

http://www.researcherid.com/rid/JFK-4855-2023

Présentation

TBD

Publications

Article dans une revue (27)

Rigidity-Driven Structural Isomers in the NaCl–Ga2S3 System: Implications for Energy Storage Maria Bokova,Mohammad Kassem,Takeshi Usuki,Andrey Tverjanovich,Anton Sokolovet al. Small Science, 2025, 5 (1), pp.2400371. ⟨10.1002/smsc.202400371⟩ Article dans une revue hal-04818039v1
Atomic Structure and Dynamics of Unusual and Wide‐Gap Phase‐Change Chalcogenides: A GeTe 2 Case Takeshi Usuki,Chris Benmore,Andrey Tverjanovich,Sergei Bereznev,Maxim Khomenkoet al. physica status solidi (RRL) - Rapid Research Letters (pss RRL), 2024, pp.2300482. ⟨10.1002/pssr.202300482⟩ Article dans une revue hal-04443961v1
Decoding the Atomic Structure of Ga2Te5 Pulsed Laser Deposition Films for Memory Applications Using Diffraction and First-Principles Simulations Andrey Tverjanovich,Chris Benmore,Maxim Khomenko,Anton Sokolov,Daniele Fontanariet al. Nanomaterials, 2023, 13 (14), pp.2137. ⟨10.3390/nano13142137⟩ Article dans une revue hal-04217020v1
Glassy and liquid Sb2S3 : insight into the structure and dynamics of a promising functional material Mohammad Kassem,Chris Benmore,Andrey Tverjanovich,Takeshi Usuki,Maxim Khomenkoet al. Journal of Materials Chemistry C, 2023, 11 (14), pp.4654-4673. ⟨10.1039/D3TC00081H⟩ Article dans une revue hal-04124971v1
Raman spectroscopy and DFT modelling of Tl2S-GeS2 crystals and glasses Maria Bokova,Alla Paraskiva,Daniele Fontanari,Arnaud Cuisset,Mohammad Kassemet al. Journal of Non-Crystalline Solids, 2023, 601, pp.122055. ⟨10.1016/j.jnoncrysol.2022.122055⟩ Article dans une revue hal-04217111v1
Chemically-invariant percolation in silver thioarsenate glasses and two ion-transport regimes over 5 orders of magnitude in Ag content Rayan Zaiter,Mohammad Kassem,Daniele Fontanari,Maria Bokova,Fabrice Cousinet al. Journal of Non-Crystalline Solids, 2022, 584, pp.121513. ⟨10.1016/j.jnoncrysol.2022.121513⟩ Article dans une revue hal-04217169v1
Deciphering Fast Ion Transport in Glasses: A Case Study of Sodium and Silver Vitreous Sulfides Mohammad Kassem,Tinehinane Bounazef,Anton Sokolov,Maria Bokova,Daniele Fontanariet al. Inorganic Chemistry, 2022, 61 (32), pp.12870-12885. ⟨10.1021/acs.inorgchem.2c02142⟩ Article dans une revue hal-04217125v1
Unexpected role of metal halides in a chalcogenide glass network Rayan Zaiter,Mohammad Kassem,Daniele Fontanari,Anton Sokolov,Takeshi Usukiet al. Materials & Design, 2022, 216, pp.110547. ⟨10.1016/j.matdes.2022.110547⟩ Article dans une revue hal-03710415v1
Unraveling the Atomic Structure of Bulk Binary Ga–Te Glasses with Surprising Nanotectonic Features for Phase-Change Memory Applications Maria Bokova,Andrey Tverjanovich,Chris J Benmore,Daniele Fontanari,Anton Sokolovet al. ACS Applied Materials & Interfaces, 2021, 13 (31), pp.37363 - 37379. ⟨10.1021/acsami.1c09070⟩ Article dans une revue hal-04217817v1
Bulk Glassy GeTe2 : A Missing Member of the Tetrahedral GeX2 Family and a Precursor for the Next Generation of Phase-Change Materials Andrey Tverjanovich,Maxim Khomenko,Chris Benmore,Maria Bokova,Anton Sokolovet al. Chemistry of Materials, 2021, 33 (3), pp.1031-1045. ⟨10.1021/acs.chemmater.0c04409⟩ Article dans une revue hal-04210136v1
Atypical phase-change alloy Ga 2 Te 3 : atomic structure, incipient nanotectonic nuclei, and multilevel writing Andrey Tverjanovich,Maxim Khomenko,Chris Benmore,Sergei Bereznev,Anton Sokolovet al. Journal of Materials Chemistry C, 2021, 9 (47), pp.17019-17032. ⟨10.1039/D1TC03850H⟩ Article dans une revue hal-04217950v2
Glassy GaS: transparent and unusually rigid thin films for visible to mid-IR memory applications Andrey Tverjanovich,Maxim Khomenko,Sergei Bereznev,Daniele Fontanari,Anton Sokolovet al. Physical Chemistry Chemical Physics, 2020, 22 (44), pp.25560-25573. ⟨10.1039/d0cp04697c⟩ Article dans une revue hal-02999002v1
Intrinsic second‐order nonlinearity in chalcogenide glasses containing HgI 2 Andrey Tverjanovich,Evgenii Borisov,Mohammad Kassem,Pascal Masselin,Daniele Fontanariet al. Journal of the American Ceramic Society, 2020, 103 (5), pp.3070-3075. ⟨10.1111/jace.17026⟩ Article dans une revue hal-04220469v1
Characterization of the Observed Electric Field and Molecular Relaxation Times for Millimeter-Wave Chirped Pulse Instrumentation Guillaume Dhont,Cédric Bray,Gaël Mouret,Arnaud Cuisset,Francis Hindleet al. Journal of Infrared, Millimeter and Terahertz Waves, 2020, 41 (8), pp.1009-1021. ⟨10.1007/s10762-020-00716-z⟩ Article dans une revue hal-02932920v1
Chemical and Structural Variety in Sodium Thioarsenate Glasses Studied by Neutron Diffraction and Supported by First-Principles Simulations Mohammad Kassem,Tinehinane Bounazef,Daniele Fontanari,Anton Sokolov,Maria Bokovaet al. Inorganic Chemistry, 2020, 59 (22), pp.16410-16420. ⟨10.1021/acs.inorgchem.0c02220⟩ Article dans une revue hal-04217970v1
Molecules probed with a slow chirped-pulse excitation: Analytical model of the free-induction-decay signal Daniele Fontanari,Cédric Bray,Guillaume Dhont,Gaël Mouret,Arnaud Cuissetet al. Physical Review A, 2019, 100 (4), pp.043407. ⟨10.1103/PhysRevA.100.043407⟩ Article dans une revue hal-02322177v1
Bent HgI2 Molecules in the Melt and Sulfide Glasses: Implications for Nonlinear Optics Mohammad Kassem,Maria Bokova,Andrey S. Tverjanovich,Daniele Fontanari,David Le Coqet al. Chemistry of Materials, 2019, 31 (11), pp.4103-4112. ⟨10.1021/acs.chemmater.9b00860⟩ Article dans une revue hal-02177797v1
Ionic transport and atomic structure of AgI-HgS-GeS2 glasses Rayan Zaiter,Mohammad Kassem,Daniele Fontanari,Arnaud Cuisset,Chris J Benmoreet al. Pure and Applied Chemistry, 2019, 91 (11), pp.1807 - 1820. ⟨10.1515/pac-2019-0103⟩ Article dans une revue hal-04218066v1
Conformational landscape and inertial defect of methoxyphenol isomers studied by mm-wave spectroscopy and quantum chemistry calculations Atef Jabri,Cédric Bray,Gaël Mouret,Robin Bocquet,Arnaud Cuissetet al. The Journal of Chemical Physics, 2019, 150, pp.104303. ⟨10.1063/1.5089426⟩ Article dans une revue hal-03173780v1
Chirped Pulse Spectrometer Operating at 200 GHz Francis Hindle,Cédric Bray,Kevin Hickson,Daniele Fontanari,Meriem Mouelhiet al. Journal of Infrared, Millimeter and Terahertz Waves, 2018, 39 (1), pp.105 - 119. ⟨10.1007/s10762-017-0445-3⟩ Article dans une revue hal-01892031v2
Structure of Se–Te glasses by Raman spectroscopy and DFT modeling Andrey Tverjanovich,Arnaud Cuisset,Daniele Fontanari,Eugène Bychkov Journal of the American Ceramic Society, 2018, 101 (11), pp.5188-5197. ⟨10.1111/jace.15758⟩ Article dans une revue hal-04210107v1
Full Conformational Landscape of 3‐Methoxyphenol Revealed by Room Temperature mm‐wave Rotational Spectroscopy Supported by Quantum Chemical Calculations Anthony Roucou,Daniele Fontanari,Guillaume Dhont,Atef Jabri,Cédric Brayet al. ChemPhysChem, 2018, 19 (13), pp.1572-1578. ⟨10.1002/cphc.201800148⟩ Article dans une revue hal-04220467v1
Coherent states for the quantum complete rigid rotor Daniele Fontanari,Dimitrií Sadovskií Journal of Geometry and Physics, 2018, 129, pp.70-89. ⟨10.1016/j.geomphys.2018.02.021⟩ Article dans une revue hal-04218562v1
High resolution study of the ν2 and ν5 rovibrational fundamental bands of thionyl chloride: Interplay of an evolutionary algorithm and a line-by-line analysis Anthony Roucou,Marie-Aline Martin-Drumel,Sven Thorwirth,Daniele Fontanari,W. Leo Meertset al. The Journal of Chemical Physics, 2017, 147 (5), pp.054303. ⟨10.1063/1.4996655⟩ Article dans une revue hal-04218554v1
Quantum manifestations of Nekhoroshev stability Daniele Fontanari,Francesco Fassò,Dimitrií Sadovskií Physics Letters A, 2016, 380 (39), pp.3167-3172. ⟨10.1016/j.physleta.2016.07.047⟩ Article dans une revue hal-04218391v1
An Application of Nekhoroshev Theory to the Study of the Perturbed Hydrogen Atom Francesco Fassò,Daniele Fontanari,Dimitrií Sadovskií Mathematical Physics, Analysis and Geometry, 2015, 18 (1), pp.30. ⟨10.1007/s11040-015-9200-y⟩ Article dans une revue hal-04218377v1
Perturbations of the hydrogen atom by inhomogeneous static electric and magnetic fields Daniele Fontanari,Dimitrií Sadovskií Journal of Physics A: Mathematical and Theoretical, 2015, 48 (9), pp.095203. ⟨10.1088/1751-8113/48/9/095203⟩ Article dans une revue hal-04210044v1

Communication dans un congrès (4)

Conformational analysis of methoxyphenol isomers using high-resolution spectroscopy and quantum chemistry calculations. Anthony Roucou,Atef Jabri,Atef Jabri,Daniele Fontanari,Pierre Asselinet al. The XIX Symposium on High Resolution Molecular Spectroscopy, Jul 2019, Nizhny Novgorod, Russia Communication dans un congrès hal-02397271v1
Modelisation of a gas phase polarization induced by a 200 GHz chirped pulse Robin Bocquet,Daniele Fontanari,Cédric Bray,Gaël Mouret,Arnaud Cuissetet al. 3rd International Conference “Terahertz and Microwave Radiation: Generation, Detection and Applications” (TERA-2018), Budker Institute of Nuclear Physics (Novosibirsk); Moscow State University; Institute of Applied Physics (Nizhny Novgorod), Oct 2018, Nizhny Novgorod, Russia. 2p. / 06001, ⟨10.1051/epjconf/201819506001⟩ Communication dans un congrès hal-04524030v1
High resolution study of the nu2 and nu5 rovibrational fundamental bands of thionyl chloride : interplay of an evolutionary algorithm and a line-by-line analysis Anthony Roucou,Guillaume Dhont,Marie-Aline Martin-Drumel,Sven Thorwirth,Daniele Fontanariet al. International Symposium on Molecular Spectroscopy - 73rd Meeting, Jun 2018, Urbana-champaign, United States Communication dans un congrès hal-04535331v1
High resolution study of the nu2 and nu5 rovibrational fundamental bands of thionyl chloride : interplay of an evolutionary algorithm and a line-by-line analysis Anthony Roucou,Guillaume Dhont,Arnaud Cuisset,Marie-Aline Martin-Drumel,Sven Thorwirthet al. Thematic doctoral school METAMORPHOSE, May 2018, Louvain -la-Neuve, Belgium Communication dans un congrès hal-04535401v1

Poster de conférence (6)

Modeling of Iron Isotope Fractionation During Aerosol Cloud Processing Hisham Khalifeh Al Rawas,Cecilia Pech,Carmen Ciotonea,Karine Deboudt,Daniele Fontanariet al. Cross Disciplinary Project (CDP) AREA (Aerosol at the heaRt of the Earth Atmosphere system) Scientific Day, Mar 2026, Villeneuve d’Ascq (Lille), France Poster de conférence hal-05564197v1
Theoretical estimation of iron isotope fractionation during cloud processing of aerosols Guillaume Dhont,Carmen Ciotonea,Daniele Fontanari,Hisham Khalifeh Al Rawas,Maya Marinovaet al. Workshop LEFE/CHAT on theoretical physical chemistry and atmospheric chemistry, Jul 2025, Marseille, France Poster de conférence hal-05170026v1
Evolutionary algorithm-based analysis of the rovibrational SCl2 stretching bands of thionyle chloride Anthony Roucou,Guillaume Dhont,Arnaud Cuisset,Marie-Aline Martin-Drumel,Sven Thorwirthet al. 9th THz Days (GdR TeraNanoMir), Jun 2017, Dunkerque, France Poster de conférence hal-04535390v1
Analysis of the 3-methoxyphenol conformers stability by mean of high–resolution THz spectroscopy Anthony Roucou,Gaël Mouret,Daniele Fontanari,Cédric Bray,Francis Hindleet al. International Conference on Aerosol Cycle 2017 (Labex CaPPA), Mar 2017, Villeneuve d’Ascq, France Poster de conférence hal-04535395v1
Analysis of the 3-methoxyphenol conformers stability by mean of high–resolution THz spectroscopy Anthony Roucou,Gaël Mouret,Daniele Fontanari,Cédric Bray,Francis Hindleet al. Plenary Meeting - Young Researchers Forum (GdR SPECMO), May 2017, Villeneuve d’Ascq, France Poster de conférence hal-04535393v1
Analysis of the 3-methoxyphenol conformers stability by mean of high–resolution THz spectroscopy Anthony Roucou,Gaël Mouret,Cédric Bray,Daniele Fontanari,Cécile Coeuret al. The 25th International Colloquium on High Resolution Molecular Spectroscopy, Aug 2017, Helsinki, Finland Poster de conférence hal-04535379v1

Proceedings/Recueil des communications (1)

Modelisation of a gas phase polarization induced by a 200 GHz chirped pulse Robin Bocquet,Daniele Fontanari,Cédric Bray,Arnaud Cuisset,Guillaume Dhontet al. 3rd International Conference “Terahertz and Microwave Radiation: Generation, Detection and Applications” (TERA-2018), Oct 2018, Nizhny Novgorod, Russia. EPJ Web of Conferences, 195, EDP Sciences, 2p. / 06001, 2018, ⟨10.1051/epjconf/201819506001⟩ Proceedings/Recueil des communications hal-04218568v1

Chapitre d'ouvrage (1)

Ionic Conductivity and Tracer Diffusion in Glassy Chalcogenides Igor Alekseev,Daniele Fontanari,Anton Sokolov,Maria Bokova,Mohammad Kassemet al. The World Scientific Reference of Amorphous Materials, 1, World Scientific, pp.203-249, 2021, ⟨10.1142/9789811215575_0008⟩ Chapitre d'ouvrage hal-04217958v1

Thèse (1)

Quantum manifestations of the adiabatic chaos of perturbed superintegrable Hamiltonian systems Daniele Fontanari Quantum Algebra [math.QA]. Université du Littoral Côte d'Opale; Università di Padova, 2013. English. ⟨NNT : 2013DUNK0356⟩ Thèse tel-01258458v1