First Principles Study on Interstitial Oxygen in Titanium and TiFe

Hak-Sung Lee; Yong-Taek Hyun;  Chang-Seok  Oh; Dong-Won Lee

doi:10.1166/sam.2018.2859

First Principles Study on Interstitial Oxygen in Titanium and TiFe

Science of Advanced Materials ◽

10.1166/sam.2018.2859 ◽

2018 ◽

Vol 10 (1) ◽

pp. 74-77

Author(s):

Hak-Sung Lee ◽

Yong-Taek Hyun ◽

Chang-Seok Oh ◽

Dong-Won Lee

Keyword(s):

First Principles ◽

Interstitial Oxygen ◽

First Principles Study

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First-principles study of PbWO4crystal with interstitial oxygen atoms

physica status solidi (a) ◽

10.1002/pssa.200622324 ◽

2007 ◽

Vol 204 (3) ◽

pp. 776-783 ◽

Cited By ~ 5

Author(s):

Chen Teng ◽

Liu Ting-Yu ◽

Zhang Qi-Ren ◽

Li Fang-Fei ◽

Yi Zhi-Jun ◽

...

Keyword(s):

First Principles ◽

Interstitial Oxygen ◽

First Principles Study ◽

Oxygen Atoms

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Investigation of the interstitial oxygen behaviors in vanadium alloy: A first-principles study

Current Applied Physics ◽

10.1016/j.cap.2017.12.003 ◽

2018 ◽

Vol 18 (2) ◽

pp. 183-190 ◽

Cited By ~ 6

Author(s):

Xingming Zhang ◽

Yifan Li ◽

Qiaoling He ◽

Ruilian Li ◽

Lei Deng ◽

...

Keyword(s):

First Principles ◽

Interstitial Oxygen ◽

Vanadium Alloy ◽

First Principles Study

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First-principles study on electronic structures and absorption bands of CaWO4crystals with interstitial oxygen atoms

physica status solidi (a) ◽

10.1002/pssa.200723141 ◽

2007 ◽

Vol 204 (9) ◽

pp. 3159-3164 ◽

Cited By ~ 3

Author(s):

Shao Ze-Xu ◽

Zhang Qi-Ren ◽

Liu Ting-Yu ◽

Chen Jian-Yu

Keyword(s):

First Principles ◽

Electronic Structures ◽

Interstitial Oxygen ◽

Absorption Bands ◽

First Principles Study ◽

Oxygen Atoms

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First-principles study of interstitial oxygen in potassium dihydrogen phosphate crystals

Physical Review B ◽

10.1103/physrevb.72.184105 ◽

2005 ◽

Vol 72 (18) ◽

Cited By ~ 16

Author(s):

Kunpeng Wang ◽

Changshui Fang ◽

Jianxiu Zhang ◽

C. S. Liu ◽

Robert I. Boughton ◽

...

Keyword(s):

First Principles ◽

Potassium Dihydrogen Phosphate ◽

Dihydrogen Phosphate ◽

Interstitial Oxygen ◽

Potassium Dihydrogen ◽

First Principles Study

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First-principles study on the effect of the interstitial oxygen ion on the spectral properties of PWO crystal and the origin of the green luminescence band

Solid State Communications ◽

10.1016/j.ssc.2007.03.035 ◽

2007 ◽

Vol 142 (11) ◽

pp. 647-650 ◽

Cited By ~ 5

Author(s):

Xiuyan Zhang ◽

Qiren Zhang ◽

Tingyu Liu

Keyword(s):

First Principles ◽

Spectral Properties ◽

Luminescence Band ◽

Interstitial Oxygen ◽

Green Luminescence ◽

First Principles Study ◽

Oxygen Ion

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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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