Works matching DE "PHONON dispersion relations"

Results: 99

Evaluations on the thermal properties of Cs–B–O compounds using density functional theory and phonon vibration calculations.

Published in:

Journal of Nuclear Science & Technology, 2025, v. 62, n. 6, p. 542, doi. 10.1080/00223131.2025.2451824

By:

Suzuki, Chikashi

Publication type:

Article

Crystal dynamics of zinc chalcogenides I: an application to ZnS.

Published in:

Turkish Journal of Physics, 2015, v. 39, n. 3, p. 242, doi. 10.3906/fiz-1412-11

By:

DUBEY, Jay Prakash;
TIWARI, Raj Kishore;
UPADHYAYA, Kripa Shankar;
PANDEY, Pramod Kumar

Publication type:

Article

Experimental and theoretical directional dependence of optical polar phonons in the LiNbO3 single crystal: New and complete assignment of the normal mode frequencies.

Published in:

Physica Status Solidi (B), 2016, v. 253, n. 3, p. 573, doi. 10.1002/pssb.201552428

By:

Maïmounatou, B.;
Mohamadou, B.;
Erasmus, R.

Publication type:

Article

Phonon signature of the high-pressure rocksalt phase of InN.

Published in:

Physica Status Solidi (B), 2015, v. 252, n. 9, p. 2104, doi. 10.1002/pssb.201552126

By:

Kunc, K.;
Polian, A.;
Demangeot, F.;
Briot, O.

Publication type:

Article

Pressure effects on structural and elastic properties of BeO from first-principles calculations.

Published in:

Physica Status Solidi (B), 2015, v. 252, n. 1, p. 212, doi. 10.1002/pssb.201451125

By:

Luo, Fen;
Guo, Zhi‐Cheng;
Zhang, Xiu‐Lu;
Yuan, Chang‐Ying;
Liu, Cheng‐An;
Cai, Ling‐Cang

Publication type:

Article

Crossover from ballistic to diffusive thermal conductance in helically coiled carbon nanotubes.

Published in:

Physica Status Solidi (B), 2014, v. 251, n. 12, p. 2401, doi. 10.1002/pssb.201451170

By:

Popović, Zoran P.;
Damnjanović, Milan;
Milošević, Ivanka

Publication type:

Article

Application of Deep-Learning Potential in Simulating the Structural and Physical Characteristics of Platinum.

Published in:

Computers, Materials & Continua, 2025, v. 83, n. 1, p. 685, doi. 10.32604/cmc.2025.060713

By:

Chen, Keyuan;
Zhang, Xingkao;
Ma, Li;
Ye, Jueyi;
Qiu, Qi;
Zhang, Haoxiang;
Rong, Ju;
Sui, Yudong;
Yu, Xiaohua;
Feng, Jing

Publication type:

Article

Delocalized Nonlinear Vibrational Modes in Bcc Lattice for Testing and Improving Interatomic Potentials.

Published in:

Computers, Materials & Continua, 2025, v. 82, n. 3, p. 3797, doi. 10.32604/cmc.2025.062079

By:

Ryabov, Denis S.;
Kosarev, Igor V.;
Xiong, Daxing;
Kudreyko, Aleksey A.;
Dmitriev, Sergey V.

Publication type:

Article

First Principles Study of Cerium Monochalcogenides.

Published in:

Advances in Condensed Matter Physics, 2014, p. 1, doi. 10.1155/2014/780245

By:

Eryiğit, Recep

Publication type:

Article

A first principle study of the structural, electronic, and temperature-dependent thermodynamic properties of graphene/MoS2 heterostructure.

Published in:

Journal of Molecular Modeling, 2020, v. 26, n. 2, p. 1, doi. 10.1007/s00894-020-4306-y

By:

Hossain, Md. Tanver;
Rahman, Md. Ashiqur

Publication type:

Article

First-principles study for thermodynamic properties of wurtzite indium pnictides.

Published in:

Journal of Thermal Analysis & Calorimetry, 2016, v. 124, n. 3, p. 1341, doi. 10.1007/s10973-016-5298-9

By:

Dabhi, Shweta;
Jha, Prafulla

Publication type:

Article

Dispersion of Acoustic Waves in Anodic Aluminum Oxide Phononic Crystals.

Published in:

Journal of Applied Spectroscopy, 2025, v. 92, n. 1, p. 38, doi. 10.1007/s10812-025-01875-4

By:

Abdurakhmonov, S. D.;
Ashurov, M. S.

Publication type:

Article

Second gradient continuum model for anisotropic elastic and piezoelectric structures calibrated based on phonon dispersion relations.

Published in:

Mathematics & Mechanics of Solids, 2023, v. 28, n. 10, p. 2326, doi. 10.1177/10812865231160733

By:

Solyaev, Yury

Publication type:

Article

Numerical Investigation in Nitinol Lattice Stability and Safe Usage in Replacing Hard Tissue.

Published in:

Iraqi Journal of Science, 2023, v. 64, n. 6, p. 2843, doi. 10.24996/ijs.2023.64.6.15

By:

Hiadrah, Soha S.;
Al shadidi, Zina A.

Publication type:

Article

First low-spin carbodiimide, Fe2(NCN)3, predicted from first-principles investigations.

Published in:

Zeitschrift für Naturforschung B: A Journal of Chemical Sciences, 2021, v. 76, n. 10-12, p. 783, doi. 10.1515/znb-2021-0128

By:

Chen, Hao;
Xiang, Hongping

Publication type:

Article

First principles study of L10 FeNi at the Earth's core conditions.

Published in:

High Temperatures - High Pressures, 2017, v. 46, n. 2, p. 141

By:

Pandya, N. Y.;
Mevada, A. D.;
Gajjar, P. N.

Publication type:

Article

PHONON DYNAMICAL STUDY OF COPPER BY USING [VTBFS] MODEL.

Published in:

Journal of Science & Arts, 2017, v. 17, n. 2, p. 309

By:

SRIVASTAVA, UMESH CHANDRA

Publication type:

Article

L12 yapıdaki Co3Al ve Co3Ta alaşımlarının mekanik ve dinamik özellikleri.

Published in:

Journal of the Faculty of Engineering & Architecture of Gazi University / Gazi Üniversitesi Mühendislik Mimarlık Fakültesi Dergisi,, 2017, v. 32, n. 2, p. 377, doi. 10.17341/gazimmfd.322160

By:

Örnek, Osman;
İyigör, Ahmet;
Arıkan, Nihat

Publication type:

Article

First-principles calculations of the dynamical and thermodynamic properties of lead chalcogenides PbX (X = S, Se, Te).

Published in:

Chalcogenide Letters, 2022, v. 19, n. 11, p. 793, doi. 10.15251/CL.2022.1911.793

By:

Yu, Y.;
Kong, X. G.;
Shen, Y. H.;
Yin, G. Q.

Publication type:

Article

STRUCTURAL AND VIBRATIONAL PROPERTIES OF CHALCOPYRITE CuGaTe2: A FIRST-PRINCIPLES STUDY.

Published in:

Chalcogenide Letters, 2017, v. 14, n. 10, p. 447

By:

YU, Y.;
SHEN, Y. H.;
DENG, J.;
ZHENG, X. L.;
ZHAO, G. D.

Publication type:

Article

3D Matter Made to Order.

Published in:

Advanced Functional Materials, 2024, v. 34, n. 20, p. 1, doi. 10.1002/adfm.202315919

By:

Blasco, Eva;
Lemmer, Uli;
Selhuber‐Unkel, Christine;
Wegener, Martin

Publication type:

Article

Inelastic X-ray scattering with very high resolution at the ESRF.

Published in:

Crystallography Reports, 2017, v. 62, n. 1, p. 1, doi. 10.1134/S1063774517010096

By:

Krisch, M.;
Sette, F.

Publication type:

Article

First Principles Study of the Vibrational and Thermal Properties of Sn-Based Type II Clathrates, CsxSn136 (0 ≤ x ≤ 24) and Rb24Ga24Sn112.

Published in:

Inorganics, 2019, v. 7, n. 6, p. 74, doi. 10.3390/inorganics7060074

By:

Xue, Dong;
Myles, Charles W.

Publication type:

Article

Phonon Transport Characteristics of Nano-Silicon Thin Films Irradiated by Ultrafast Laser under Dispersion Relation.

Published in:

Buildings (2075-5309), 2024, v. 14, n. 1, p. 210, doi. 10.3390/buildings14010210

By:

Mao, Yudong;
Liu, Shouyu;
Liu, Jiying;
Yu, Mingzhi;
Li, Xinwei;
Kim, Moon Keun;
Yang, Kaimin

Publication type:

Article

Phononic modulation of spin-lattice relaxation in molecular qubit frameworks.

Published in:

Nature Communications, 2024, v. 15, n. 1, p. 1, doi. 10.1038/s41467-024-54989-2

By:

Zhou, Aimei;
Li, Denan;
Tan, Mingshu;
Lv, Yanpei;
Pang, Simin;
Zhao, Xinxing;
Shi, Zhifu;
Zhang, Jun;
Jin, Feng;
Liu, Shi;
Sun, Lei

Publication type:

Article

A Theoretical Investigation on the Physical Properties of Zirconium Trichalcogenides, ZrS 3 , ZrSe 3 and ZrTe 3 Monolayers.

Published in:

Energies (19961073), 2022, v. 15, n. 15, p. 5479, doi. 10.3390/en15155479

By:

Mortazavi, Bohayra;
Shojaei, Fazel;
Yagmurcukardes, Mehmet;
Makaremi, Meysam;
Zhuang, Xiaoying

Publication type:

Article

The Importance of the Debye Bosons (Sound Waves) for the Lattice Dynamics of Solids.

Published in:

International Journal of Thermodynamics, 2020, v. 23, n. 2, p. 59, doi. 10.5541/ijot.649929

By:

Köbler, U.

Publication type:

Article

The Origin of Ultralow Thermal Conductivity in InTe: Lone-Pair-Induced Anharmonic Rattling.

Published in:

Angewandte Chemie International Edition, 2016, v. 55, n. 27, p. 7792, doi. 10.1002/anie.201511737

By:

Jana, Manoj K.;
Pal, Koushik;
Waghmare, Umesh V.;
Biswas, Kanishka

Publication type:

Article

The Mechanic and Lattice Dynamical Properties on Stability of REMg (RE=Dy, Ho, Er) Alloys.

Published in:

Gazi University Journal of Science, 2014, v. 27, n. 2, p. 761

By:

ÖZTEKİN ÇİFTCİ, Yasemin;
KOÇAK, Belgin

Publication type:

Article

First principles LDA+U and GGA+U study of HfO2: Dependence on the effective U parameter.

Published in:

Gazi University Journal of Science, 2014, v. 27, n. 1, p. 627

By:

ÇİFTCİ, Yasemin Ö.;
ERGÜN, A. H.;
ÇOLAKOĞLU, K.;
DELİGÖZ, E.

Publication type:

Article

Strain-induced quantum spin Hall effect in methyl-substituted germanane GeCH3.

Published in:

Scientific Reports, 2014, p. 1, doi. 10.1038/srep07297

By:

Yandong Ma;
Ying Dai;
Wei Wei;
Baibiao Huang;
Myung-Hwan Whangbo

Publication type:

Article

New First Order Raman-active Modes in Few Layered Transition Metal Dichalcogenides.

Published in:

Scientific Reports, 2014, p. 1, doi. 10.1038/srep04215

By:

Terrones, H.;
Del Corro, E.;
Feng, S.;
Poumirol, J. M.;
Rhodes, D.;
Smirnov, D.;
Pradhan, N. R.;
Lin, Z.;
Nguyen, M. A. T.;
Elías, A. L.;
Mallouk, T. E.;
Balicas, L.;
Pimenta, M. A.;
Terrones, M.

Publication type:

Article

An investigation of electron-phonon coupling via phonon dispersion measurements in graphite using angle-resolved photoelectron spectroscopy.

Published in:

Scientific Reports, 2013, p. 1, doi. 10.1038/srep03031

By:

Shin-ichiro Tanaka;
Masaharu Matsunami;
Shin-ichi Kimura

Publication type:

Article

Experimental Review of Graphene.

Published in:

ISRN Condensed Matter Physics, 2012, p. 1, doi. 10.5402/2012/501686

By:

Cooper, Daniel R.;
D'Anjou, Benjamin;
Ghattamaneni, Nageswara;
Harack, Benjamin;
Hilke, Michael;
Horth, Alexandre;
Majlis, Norberto;
Massicotte, Mathieu;
Vandsburger, Leron;
Whiteway, Eric;
Yu, Victor

Publication type:

Article

Thermal Transport Evolution Due to Nanostructural Transformations in Ga-Doped Indium-Tin-Oxide Thin Films.

Published in:

Nanomaterials (2079-4991), 2021, v. 11, n. 5, p. 1126, doi. 10.3390/nano11051126

By:

Cocemasov, Alexandr;
Brinzari, Vladimir;
Jeong, Do-Gyeom;
Korotcenkov, Ghenadii;
Vatavu, Sergiu;
Lee, Jong S.;
Nika, Denis L.;
Trukhanov, Alex

Publication type:

Article

Inelastic Neutron Scattering Study of Phonon Dispersion Relation in Higher Manganese Silicides.

Published in:

Crystals (2073-4352), 2023, v. 13, n. 5, p. 741, doi. 10.3390/cryst13050741

By:

Belanger, Randy;
Clancy, James Patrick;
Jain, Sheetal;
Yamani, Zahra;
Tseng, Yu-Chih;
Kim, Young-June

Publication type:

Article

Structural and Vibrational Characteristics of Solid Naphthalene (C10H8) Through the Use of van der Waals three-body force shell (VTBFS) Model.

Published in:

Oriental Journal of Chemistry, 2022, v. 38, n. 3, p. 762, doi. 10.13005/ojc/380329

By:

SRIVASTAVA, UMESH CHANDRA;
SINGH, SHYAMENDRA PRATAP

Publication type:

Article

First principle studies on the structures, electronic properties and Raman spectrums of monolayer WX2 (X = S, Se, Te) under strain condition.

Published in:

Modern Physics Letters B, 2021, v. 35, n. 8, p. N.PAG, doi. 10.1142/S0217984921501359

By:

Huang, Shan;
Wang, Yanping;
Fan, Yawen;
Feng, Jinjiao;
Zhao, Hui;
Zhang, Yang

Publication type:

Article

Vibrational spectra and phonon dispersion analysis of a single-walled zigzag carbon nanotube: A first principles study.

Published in:

Canadian Journal of Physics, 2016, v. 94, n. 10, p. 1112, doi. 10.1139/cjp-2016-0421

By:

Sharma, Deepa;
Jaggi, Neena

Publication type:

Article

The effects on the lattice dynamical properties of the temperature and pressure in random NiPd alloy.

Published in:

Canadian Journal of Physics, 2013, v. 91, n. 10, p. 833, doi. 10.1139/cjp-2013-0090

By:

Kazanc, S.

Publication type:

Article

The Origin of Ultralow Thermal Conductivity in InTe: Lone-Pair-Induced Anharmonic Rattling.

Published in:

Angewandte Chemie, 2016, v. 128, n. 27, p. 7923, doi. 10.1002/ange.201511737

By:

Jana, Manoj K.;
Pal, Koushik;
Waghmare, Umesh V.;
Biswas, Kanishka

Publication type:

Article

The effects of dopant impurities on CuZnSnS system Raman properties.

Published in:

Journal of Materials Science, 2015, v. 50, n. 4, p. 1613, doi. 10.1007/s10853-014-8722-1

By:

Sarswat, Prashant;
Free, Michael

Publication type:

Article

Electronic and phonon properties of the full-Heusler alloys XYAl (X = Co, Fe and Y = Cr, Sc): a density functional theory study.

Published in:

Journal of Materials Science, 2014, v. 49, n. 12, p. 4180, doi. 10.1007/s10853-014-8113-7

By:

Arıkan, N.;
İyigör, A.;
Candan, A.;
Uğur, Ş.;
Charifi, Z.;
Baaziz, H.;
Uğur, G.

Publication type:

Article

Mapping Phonon Dispersion Surfaces at Nanometer Scale.

Published in:

2023

By:

Haas, Benedikt;
Radtke, Guillaume;
Quillin, Steven C;
Lovejoy, Tracy C;
Dellby, Niklas;
Krivanek, Ondrej L;
Hammud, Adnan;
Schröder, Tim;
Koch, Christoph T

Publication type:

Abstract

Unveiling Phonon Dispersion Behavior of AlN/GaN Heterostructures Using EELS.

Published in:

2023

By:

Reyes-González, Joaquin E;
Dellby, Niklas;
Plotkin-Swing, Benjamin;
Wang, Ping;
Pandey, Ayush;
Mi, Zetian;
Lagos, Maureen J

Publication type:

Abstract

The effect of non-analytical corrections on the phononic thermal transport in InX (X = S, Se, Te) monolayers.

Published in:

Scientific Reports, 2020, v. 10, n. 1, p. 1, doi. 10.1038/s41598-020-57644-0

By:

Shafique, Aamir;
Shin, Young-Han

Publication type:

Article

Effects of pre-stress and surface stress on phonon thermal conductivity of rectangular Si nanowires.

Published in:

Applied Physics A: Materials Science & Processing, 2015, v. 119, n. 1, p. 253, doi. 10.1007/s00339-014-8958-2

By:

Zhu, Linli;
Ruan, Haihui

Publication type:

Article

Density functional study of CoFeCrZ (Z=Al, Si, Ga, Ge) quaternary Heusler alloys for phonon spectra.

Published in:

International Journal of Modern Physics B: Condensed Matter Physics; Statistical Physics; Applied Physics, 2020, v. 34, n. 25, p. N.PAG, doi. 10.1142/S021797922050215X

By:

Ahmed, Muhammad;
Afaq, A.;
Bakar, Abu;
Asif, Muhammad

Publication type:

Article

Theoretical study of phonon dispersion, elastic, mechanical and thermodynamic properties of barium chalcogenides.

Published in:

International Journal of Modern Physics B: Condensed Matter Physics; Statistical Physics; Applied Physics, 2018, v. 32, n. 8, p. 1, doi. 10.1142/S0217979218500923

By:

Musari, A. A.;
Orukombo, S. A.

Publication type:

Article

Structural, electronic, elastic and lattice dynamical properties of CdIn2Te4 under pressure from first principle.

Published in:

International Journal of Modern Physics B: Condensed Matter Physics; Statistical Physics; Applied Physics, 2018, v. 32, n. 3, p. -1, doi. 10.1142/S0217979218500261

By:

Zhang, Shaobo;
Shi, Liwei

Publication type:

Article