IR Spectroscopy of PbZr1–xTixO3 Material: A Complementary Experimental/Ab Initio Calculations Approach of a Solid Solution-Reference-Cited by-同舟云学术

IR Spectroscopy of PbZr_1–xTi_xO₃ Material: A Complementary Experimental/Ab Initio Calculations Approach of a Solid Solution

Published:2022-07-26 Issue:30 Volume:126 Page:12860-12869
ISSN:1932-7447
Container-title:The Journal of Physical Chemistry C
language:en
Short-container-title:J. Phys. Chem. C

Author:

Cervasio Rebecca¹,Peperstraete Yoann¹²,Maroutian Thomas³,Haumont Raphaël²,Verseils Marine¹,Brubach Jean-Blaise¹,Tétot Robert²,Creuze Jérôme²^ORCID,Roy Pascale¹^ORCID,Amzallag Emilie²

Affiliation:

1. Synchrotron SOLEIL, L’Orme des Merisiers, Saint-Aubin BP 48, 91192 Gif-sur-Yvette Cedex, France

2. ICMMO/SP2M, UMR 8182, Université Paris-Saclay, bât. 410 avenue du Doyen Georges Poitou, Orsay-F 91405, France

3. Centre for Nanoscience and Nanotechnology (C2N), CNRS UMR 9001, Université Paris-Saclay, Palaiseau 91120, France

Publisher

American Chemical Society (ACS)

Subject

Surfaces, Coatings and Films,Physical and Theoretical Chemistry,General Energy,Electronic, Optical and Magnetic Materials

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jpcc.2c03046

Reference43 articles.

1. Finite-Temperature Properties ofPb(Zr1−xTix)O3Alloys from First Principles

2. Local structure and macroscopic properties inPbMg1∕3Nb2∕3O3−PbTiO3andPbZn1∕3Nb2∕3O3−PbTiO3solid solutions

3. Screening for high-performance piezoelectrics using high-throughput density functional theory

4. Multiscale modeling for ferroelectric materials: identification of the phase-field model’s free energy for PZT from atomistic simulations

5. Synthesis, optical and ferroelectric properties of PZT thin films: experimental and theoretical investigation

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