First-principles study of structural, electronic, elastic, vibrational and thermodynamics properties of LaX3 (X=Sn, Tl, Pb and Bi) compounds under pressure

First-principles study on the lattice dynamics and thermodynamics properties of CaFe2As2

Physica B Condensed Matter ◽

10.1016/j.physb.2010.07.015 ◽

2010 ◽

Vol 405 (19) ◽

pp. 4226-4230 ◽

Cited By ~ 1

Author(s):

Miao Rende ◽

Yanbiao Li ◽

Zhong Bai ◽

Liang Wang ◽

Li_an Chen

Keyword(s):

First Principles ◽

Lattice Dynamics ◽

First-principles study on the structural, elastic, and thermodynamics properties of Ni3X (X: Al, Mo, Ti, Pt, Si, Nb, V, and Zr) intermetallic compounds

Applied Physics A ◽

10.1007/s00339-013-8201-6 ◽

2013 ◽

Vol 116 (3) ◽

pp. 1161-1172 ◽

Cited By ~ 12

Author(s):

Qiang Chen ◽

Zhiwei Huang ◽

Zude Zhao ◽

Chuankai Hu

Keyword(s):

Intermetallic Compounds ◽

First Principles ◽

First-principles study of the electronic, vibrational, electron–phonon interaction and thermodynamics properties of ZrNi2Ga

Journal of Physics Condensed Matter ◽

10.1088/0953-8984/21/7/075501 ◽

2009 ◽

Vol 21 (7) ◽

pp. 075501 ◽

Cited By ~ 5

Author(s):

Wenmei Ming ◽

Yi Liu ◽

Wei Zhang ◽

Jianzhi Zhao ◽

Yugui Yao

Keyword(s):

First Principles ◽

Phonon Interaction ◽

Electron Phonon Interaction ◽

Письма в Журнал экспериментальной и теоретической физики ◽

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

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

Письма в Журнал экспериментальной и теоретической физики ◽

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

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

FIRST-PRINCIPLES INVESTIGATION OF THE THERMODYNAMICS PROPERTIES OF Al3Sc AND Al3Zr INTERMETALLICS

ACTA METALLURGICA SINICA ◽

10.3724/sp.j.1037.2012.00659 ◽

2013 ◽

Vol 49 (4) ◽

pp. 501 ◽

Cited By ~ 2

Author(s):

Xudong ZHANG ◽

Shaoqing WANG

Keyword(s):

First Principles ◽

Thermodynamics Properties

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

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.

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

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 ◽