First-principles study of structural instabilities in halide-based perovskites: Competition between ferroelectricity and ferroelasticity

J. W. Flocken; R. A. Guenther; J. R. Hardy; L. L. Boyer

doi:10.1103/physrevb.31.7252

First-principles study of structural instabilities in halide-based perovskites: Competition between ferroelectricity and ferroelasticity

Physical Review B ◽

10.1103/physrevb.31.7252 ◽

1985 ◽

Vol 31 (11) ◽

pp. 7252-7260 ◽

Cited By ~ 35

Author(s):

J. W. Flocken ◽

R. A. Guenther ◽

J. R. Hardy ◽

L. L. Boyer

Keyword(s):

First Principles ◽

First Principles Study ◽

Structural Instabilities

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Coupling between magnetic ordering and structural instabilities in perovskite biferroics: A first-principles study

Physical Review B ◽

10.1103/physrevb.77.134112 ◽

2008 ◽

Vol 77 (13) ◽

Cited By ~ 45

Author(s):

Nirat Ray ◽

Umesh V. Waghmare

Keyword(s):

First Principles ◽

Magnetic Ordering ◽

First Principles Study ◽

Structural Instabilities

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Structural instabilities in A15 materials driven by anharmonic phonons: a first-principles study

Physica B Condensed Matter ◽

10.1016/s0921-4526(00)00788-2 ◽

2001 ◽

Vol 296 (1-3) ◽

pp. 120-124 ◽

Cited By ~ 3

Author(s):

Barry M. Klein ◽

Z.W. Lu

Keyword(s):

First Principles ◽

First Principles Study ◽

Structural Instabilities

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First-principles study of the structural instabilities in hexagonal barium titanate: Coupling between the soft optical and the acoustic Modes

Ferroelectrics ◽

10.1080/00150190008216228 ◽

2000 ◽

Vol 237 (1) ◽

pp. 25-32 ◽

Cited By ~ 2

Author(s):

Jorge Íñtiguez ◽

Alberto García ◽

J. M. Pérez-Mato

Keyword(s):

Barium Titanate ◽

First Principles ◽

Acoustic Modes ◽

First Principles Study ◽

Structural Instabilities

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Revealing latent structural instabilities in perovskite ferroelectrics by layering and epitaxial strain: A first-principles study of Ruddlesden-Popper superlattices

Physical Review B ◽

10.1103/physrevb.78.064107 ◽

2008 ◽

Vol 78 (6) ◽

Cited By ~ 14

Author(s):

S. M. Nakhmanson

Keyword(s):

First Principles ◽

First Principles Study ◽

Epitaxial Strain ◽

Structural Instabilities

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FIRST-PRINCIPLES STUDY OF MAGNETISM AND HALF-METALLIC PROPERTIES OF THE D0 QUATERNARY HEUSLER ALLOYS BANYO (Y = K, RB AND CS)

Письма в Журнал экспериментальной и теоретической физики ◽

10.31857/s123456782012006x ◽

2020 ◽

Vol 111 (11-12(6)) ◽

pp. 819-819

Author(s):

S. BENATMANE ◽

S. CHERID

Keyword(s):

First Principles ◽

Heusler Alloys ◽

Half Metallic ◽

First Principles Study ◽

Quaternary Heusler Alloys

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INSIGHT INTO STRUCTURAL, ELECTRONIC, MAGNETIC AND ELASTIC PROPERTIES OF FULL-HEUSLER ALLOYS CO2YPB (Y = TI, V, FE AND MO): A ﬁRST-PRINCIPLES STUDY

Письма в Журнал экспериментальной и теоретической физики ◽

10.31857/s123456782017005x ◽

2020 ◽

Vol 112 (5-6(9)) ◽

pp. 312-312

Author(s):

A. ZITOUNI ◽

G. REMIL ◽

B. BOUADJEMI ◽

W. BENSTAALI ◽

T. LANTRI ◽

...

Keyword(s):

Elastic Properties ◽

First Principles ◽

Heusler Alloys ◽

First Principles Study ◽

Full Heusler ◽

Full Heusler Alloys ◽

Insight Into

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First-Principles Study of Mn-rich Ni-Mn-Ga Alloys: Effect of Disorder on Martensitic Transformation

Shape Memory Alloys ◽

10.21741/9781644900017-22 ◽

2018 ◽

Keyword(s):

Martensitic Transformation ◽

First Principles ◽

First Principles Study ◽

Effect Of Disorder

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Strain tuned high thermal conductivity in boron phosphide at nanometer length scales – a first-principles study

Physical Chemistry Chemical Physics ◽

10.1039/d0cp03690k ◽

2020 ◽

Vol 22 (36) ◽

pp. 20914-20921 ◽

Cited By ~ 1

Author(s):

Rajmohan Muthaiah ◽

Jivtesh Garg

Keyword(s):

Thermal Conductivity ◽

First Principles ◽

High Thermal Conductivity ◽

Biaxial Strain ◽

Length Scales ◽

First Principles Study ◽

Boron Phosphide

We report novel pathways to significantly enhance the thermal conductivity at nanometer length scales in boron phosphide through biaxial strain.

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Adjustable electronic and optical properties of BlueP/MoS2 van der Waals heterostructure by external strain: a first-principles study

Nanotechnology ◽

10.1088/1361-6528/ab978b ◽

2020 ◽

Vol 31 (37) ◽

pp. 375706 ◽

Cited By ~ 1

Author(s):

Fei Yang ◽

Junnan Han ◽

Le Zhang ◽

Xianhong Tang ◽

Zhenguo Zhuo ◽

...

Keyword(s):

Optical Properties ◽

First Principles ◽

Van Der Waals ◽

Electronic And Optical Properties ◽

First Principles Study ◽

Van Der Waals Heterostructure ◽

External Strain

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Strain effect on electronic structure and thermoelectric properties of orthorhombic SnSe: A first principles study

AIP Advances ◽

10.1063/1.4936636 ◽

2015 ◽

Vol 5 (11) ◽

pp. 117147 ◽

Cited By ~ 22

Author(s):

Do Duc Cuong ◽

S. H. Rhim ◽

Joo-Hyong Lee ◽

Soon Cheol Hong

Keyword(s):

Electronic Structure ◽

Thermoelectric Properties ◽

First Principles ◽

Strain Effect ◽

First Principles Study

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