Emilie Amzallag

Journal articles

2024

ref_biblio

Rebecca Cervasio, Emilie Amzallag, Marine Verseils, Pierre Hemme, Jean-Blaise Brubach, et al.. Quantification of Crystalline Phases in Hf 0.5 Zr 0.5 O 2 Thin Films through Complementary Infrared Spectroscopy and Ab Initio Supercell Simulations. ACS Applied Materials & Interfaces, 2024, 16 (3), pp.3829-3840. ⟨10.1021/acsami.3c13848⟩. ⟨hal-04771538⟩

Accès au texte intégral et bibtex

2022

ref_biblio

Rebecca Cervasio, Yoann Peperstraete, Thomas Maroutian, Raphaël Haumont, Marine Verseils, et al.. IR Spectroscopy of PbZr 1– x Ti x O 3 Material: A Complementary Experimental/ Ab Initio Calculations Approach of a Solid Solution. Journal of Physical Chemistry C, 2022, 126 (30), pp.12860-12869. ⟨10.1021/acs.jpcc.2c03046⟩. ⟨hal-05484023⟩

Accès au bibtex

ref_biblio

Donald Goury, Emilie Amzallag, David Bérardan, Jérôme Creuze. Ab Initio Study of the Thermodynamics of Intrinsic Point Defects in Thermoelectric Oxychalcogenide BiCuSeO. Journal of Physical Chemistry C, 2022, 126 (13), pp.5960-5969. ⟨10.1021/acs.jpcc.1c09351⟩. ⟨hal-05484063⟩

Accès au bibtex

2019

ref_biblio

Benjamin Langerome, Marine Verseils, Francesco Capitani, Jean-Blaise Brubach, Emilie Amzallag, et al.. Probing NaCl at High Pressure through Optical Studies and Ab Initio Calculations. Journal of Physical Chemistry C, 2019, 123 (25), pp.15724-15728. ⟨10.1021/acs.jpcc.9b02915⟩. ⟨hal-05096763⟩

Accès au bibtex

2018

ref_biblio

Lin Pan, Yudong Lang, Lei Zhao, David Berardan, Emilie Amzallag, et al.. Realization of n-type and enhanced thermoelectric performance of p-type BiCuSeO by controlled iron incorporation. Journal of Materials Chemistry A, 2018, 6 (27), pp.13340-13349. ⟨10.1039/C8TA03521K⟩. ⟨hal-05484227⟩

Accès au bibtex

ref_biblio

Yoann Peperstraete, Emilie Amzallag, Robert Tétot, Pascale Roy. Ab initio study for the IR spectroscopy of PbTiO 3 and PbZrO 3 , primary blocks of PbZr 1− x Ti x O 3. Journal of Physics: Condensed Matter, 2018, 30 (21), pp.215702. ⟨10.1088/1361-648X/aabcff⟩. ⟨hal-05485123⟩

Accès au bibtex

2017

ref_biblio

Wei-Wei Peng, Robert Tétot, Gang Niu, Emilie Amzallag, Bertrand Vilquin, et al.. Room-temperature soft mode and ferroelectric like polarization in SrTiO3 ultrathin films: Infrared and ab initio study. Scientific Reports, 2017, 7, pp.2160. ⟨10.1038/s41598-017-02113-4⟩. ⟨hal-01724280⟩

Accès au texte intégral et bibtex

2016

ref_biblio

N. Salles, O. Politano, E. Amzallag, Robert Tétot. Molecular dynamics study of high-pressure alumina polymorphs with a tight-binding variable-charge model. Computational Materials Science, 2016, 111, pp.181-189. ⟨10.1016/j.commatsci.2015.09.017⟩. ⟨hal-05485161⟩

Accès au bibtex

2015

ref_biblio

David Bérardan, Jing Li, Emilie Amzallag, Sunanda Mitra, Jiehe Sui, et al.. Structure and Transport Properties of the BiCuSeO-BiCuSO Solid Solution. Materials, 2015, 8 (3), pp.1043-1058. ⟨10.3390/ma8031043⟩. ⟨hal-05485220⟩

Accès au bibtex

2014

ref_biblio

Céline Barreteau, L Pan, E Amzallag, L Zhao, D Bérardan, et al.. Layered oxychalcogenide in the Bi–Cu–O–Se system as good thermoelectric materials. Semiconductor Science and Technology, 2014, 29 (6), pp.064001. ⟨10.1088/0268-1242/29/6/064001⟩. ⟨hal-02104710⟩

Accès au bibtex

2013

ref_biblio

W Peng, G Niu, R. Tétot, B Vilquin, F Raimondi, et al.. Insulator–metal transition of VO 2 ultrathin films on silicon: evidence for an electronic origin by infrared spectroscopy. Journal of Physics: Condensed Matter, 2013, 25 (44), pp.445402. ⟨10.1088/0953-8984/25/44/445402⟩. ⟨hal-04153124⟩

Accès au bibtex

ref_biblio

Robert Tétot, N. Salles, S. Landron, E. Amzallag. SrTiO3 (001) surface and strained thin films: Atomic simulations using a tight-binding variable-charge model. Surface Science : A Journal Devoted to the Physics and Chemistry of Interfaces, 2013, 616, pp.19-28. ⟨10.1016/j.susc.2013.05.015⟩. ⟨hal-05485249⟩

Accès au bibtex

2012

ref_biblio

E. Amzallag, D. Ehinon, Hervé Martinez, Michel Rérat, Isabelle Baraille. Ab initio electron energy-loss spectra and depolarization effects: Application to carbon nanotubes. International Journal of Quantum Chemistry, 2012, 112 (9), pp.2171-2184. ⟨10.1002/qua.23205⟩. ⟨hal-01498388⟩

Accès au bibtex

ref_biblio

Céline Barreteau, David Bérardan, Emilie Amzallag, Lidong Zhao, Nita Dragoe. Structural and Electronic Transport Properties in Sr-Doped BiCuSeO. Chemistry of Materials, 2012, 24 (16), pp.3168-3178. ⟨10.1021/cm301492z⟩. ⟨hal-02143251⟩

Accès au bibtex

2011

ref_biblio

A. Hallil, E. Amzallag, S. Landron, R. Tétot. Properties of rutile TiO2 surfaces from a Tight-Binding Variable-Charge model. Comparison with ab initio calculations. Surface Science : A Journal Devoted to the Physics and Chemistry of Interfaces, 2011, 605 (7-8), pp.738-745. ⟨10.1016/j.susc.2011.01.010⟩. ⟨hal-05485322⟩

Accès au bibtex

ref_biblio

W.W. Peng, P. Roy, L. Favaro, E. Amzallag, J.B. Brubach, et al.. Experimental and ab initio study of vibrational modes of stressed alumina films formed by oxidation of aluminium alloys under different atmospheres. Acta Materialia, 2011, 59 (7), pp.2723-2730. ⟨10.1016/j.actamat.2011.01.010⟩. ⟨hal-05485306⟩

Accès au bibtex

ref_biblio

Robert Tétot, A. Hallil, Emilie Amzallag, Sylvain Landron. Multi-Scale Modelling of Low Index Rutile TiO₂ Surfaces with a Tight-Binding Variable-Charge Model and Ab Initio Calculations. Materials Science Forum, 2011, 675-677 (7-8), pp.937-940. ⟨10.4028/www.scientific.net/msf.675-677.937⟩. ⟨hal-05485353⟩

Accès au bibtex

2009

ref_biblio

David Groh, Ravindra Pandey, Munima B. Sahariah, Emilie Amzallag, Isabelle Baraille, et al.. First-principles study of the optical properties of BeO in its ambient and high-pressure phases.. Journal of Physics and Chemistry of Solids, 2009, 70 (Copyright (C) 2017 American Chemical Society (ACS). All Rights Reserved.), pp.789–795. ⟨10.1016/j.jpcs.2009.03.013⟩. ⟨hal-01536049⟩

Accès au bibtex

2008

ref_biblio

E. Amzallag, Isabelle Baraille, Hervé Martinez, Michel Rérat, Danielle Gonbeau. Study of intercalated Ti atom in tetrahedral or octahedral sites of titanium disulfide (001) surfaces: Theoretical scanning tunneling microscopy images. The Journal of Chemical Physics, 2008, 128 (1), ⟨10.1063/1.2814243⟩. ⟨hal-01498390⟩

Accès au bibtex

ref_biblio

Michel Rérat, Mauro Ferrero, Emilie Amzallag, Isabelle Baraille, Roberto. Dovesi. Comparison of the polarizability of periodic systems computed by using the length and velocity operators.. Journal of Physics: Conference Series, 2008, 117 (Copyright (C) 2017 American Chemical Society (ACS). All Rights Reserved.), No pp. given. ⟨10.1088/1742-6596/117/1/012023⟩. ⟨hal-01536052⟩

Accès au bibtex

2007

ref_biblio

E. Amzallag, Hervé Martinez, Isabelle Baraille, Michel Rérat, Michel Loudet, et al.. Ti vacancies on the (001) surface of TiS2 detected by scanning tunneling microscopy: A combined experimental and theoretical study. Solid State Sciences, 2007, 9 (7), pp.594-599. ⟨10.1016/j.solidstatesciences.2007.04.010⟩. ⟨hal-01498392⟩

Accès au bibtex

ref_biblio

E. Amzallag, Isabelle Baraille, Hervé Martinez, Michel Rérat, Michel Loudet, et al.. Electronic and structural properties of Ti vacancies on the (001) surface of TiS2: Theoretical scanning tunneling microscopy images. The Journal of Chemical Physics, 2007, 126 (7), ⟨10.1063/1.2483592⟩. ⟨hal-01498391⟩

Accès au bibtex

2006

ref_biblio

Haiying He, Roberto Orlando, Miguel A. Blanco, Ravindra Pandey, Emilie Amzallag, et al.. First-principles study of the structural, electronic, and optical properties of Ga2O3 in its monoclinic and hexagonal phases.. Physical Review B: Condensed Matter and Materials Physics (1998-2015), 2006, 74 (Copyright (C) 2017 American Chemical Society (ACS). All Rights Reserved.), pp.195123/1–195123/8. ⟨10.1103/PhysRevB.74.195123⟩. ⟨hal-01536055⟩

Accès au bibtex

Conference papers

2025

ref_biblio

Rebecca Cervasio, Marine Verseils, Pierre Hemme, Jean-Blaise Brubach, Alessandro Coati, et al.. Structural and electrical properties of ferroelectric HfZrO2-based nano-capacitors for non-volatile memories. C’NANO 2025, Centre national de Compétences en Nanosciences du CNRS, Mar 2025, Paris, France. ⟨hal-05043637⟩

Accès au bibtex

2024

ref_biblio

Rebecca Cervasio, Jordan Bouaziz, Marine Verseils, Pierre Hemme, Jean-Blaise Brubach, et al.. Deposition optimization, infrared spectroscopy and ab initio simulations of ferroelectric HfZrO2 thin films. CMD31, European Physical Society; CMD-General Conference of the Condensed Matter Division, Sep 2024, Braga, Portugal. ⟨hal-04749674⟩

Accès au bibtex

2023

ref_biblio

Emilie Amzallag, Cyril Dauphin, Martine Thomas, Marine Moyon, Gerald Peyroche. Repenser la place du handicap en contexte d’enseignement : les interfaces naturelles avec les étudiants en situations de handicap comme opportunités pédagogiques ?. Questions de Pédagogie dans l’Enseignement Supérieur 2023 – Apprendre de la nature ? Enjeux pour la pédagogie dans l’enseignement supérieur, Jun 2023, Lausanne, Suisse. ⟨hal-04208269⟩

Accès au texte intégral et bibtex