Materials Science

Authors and titles for cond-mat.mtrl-sci in May 2022

[1]  arXiv:2205.00004 [pdf, other]

Title: Magnetic characterization of oblique angle deposited Co/CoO on gold nanoparticles

Authors: Johanna K. Jochum, Thomas Saerbeck, Vera Lazenka, Vincent Joly, Lianchen Shan, Hans-Gerd Boyen, Kristiaan Temst, André Vantomme, Margriet J. Van Bael

Journal-ref: Journal of Magnetism and Magnetic Materials, Volume 483, Pages 76-82 (2019)

Subjects: Materials Science (cond-mat.mtrl-sci); Mesoscale and Nanoscale Physics (cond-mat.mes-hall); Strongly Correlated Electrons (cond-mat.str-el)

[2]  arXiv:2205.00106 [pdf, ps, other]

Title: Controlled Curie temperature, magnetocrystalline anisotropy, and valley polarization in 2D ferromagnetic Janus 2H-VSeS monolayer

Authors: Cunquan Li, Yukai An

Comments: 13 pages, 13 figures

Subjects: Materials Science (cond-mat.mtrl-sci)

[3]  arXiv:2205.00231 [pdf, other]

Title: Theoretical Analysis on the Stability of 1-Pyrenebutanoic Acid Succinimidyl Ester Adsorbed on Graphene

Authors: Yasuhiro Oishi, Hirotsugu Ogi, Satoshi Hagiwara, Minoru Otani, Koichi Kusakabe

Comments: 21 pages, 5 figures, accepted for publication in ACS Omega

Subjects: Materials Science (cond-mat.mtrl-sci); Mesoscale and Nanoscale Physics (cond-mat.mes-hall)

[4]  arXiv:2205.00262 [pdf, ps, other]

Title: Dimensionality-controlled evolution of charge-transfer energy in digital nickelates superlattices

Authors: Xiangle Lu, Jishan Liu, Nian Zhang, Binping Xie, Shuai Yang, Wanling Liu, Zhicheng Jiang, Zhe Huang, Yichen Yang, Jin Miao, Wei Li, Soohyun Cho, Zhengtai Liu, Zhonghao Liu, Dawei Shen

Comments: 17 pages,4 figures

Journal-ref: Advanced Science(2021)

Subjects: Materials Science (cond-mat.mtrl-sci)

[5]  arXiv:2205.00284 [pdf, other]

Title: On quasi-nodal spheres and the spin Hall effect: the case of YH3 and CaTe

Authors: Rafael Gonzalez-Hernandez, Carlos Pinilla, Bernardo Uribe

Comments: 10 pages, 5 figures

Journal-ref: Phys. Rev. B 106, 125135 (2022)

Subjects: Materials Science (cond-mat.mtrl-sci); Algebraic Topology (math.AT)

[6]  arXiv:2205.00300 [pdf, other]

Title: Piezoelectric ferromagnetism in two dimensional FeCl$_2$

Authors: Kayahan Saritas, Sohrab Ismail-Beigi

Subjects: Materials Science (cond-mat.mtrl-sci)

[7]  arXiv:2205.00375 [pdf, other]

Title: Computational Insights into Electronic Excitations, Spin-Orbit Coupling Effects, and Spin Decoherence in Cr(IV)-based Molecular Qubits

Authors: Karolina Janicka, Aleksander L. Wysocki, Kyungwha Park

Comments: 34 pages, 7 figures

Subjects: Materials Science (cond-mat.mtrl-sci); Chemical Physics (physics.chem-ph); Quantum Physics (quant-ph)

[8]  arXiv:2205.00381 [pdf, other]

Title: Chemical Strain Engineering of MAPbI3 Perovskite Films

Authors: Yenal Yalcinkaya, Ilka M. Hermes, Tobias Seewald, Katrin Amann-Winkel, Lothar Veith, Lukas Schmidt-Mende, Stefan A.L. Weber

Subjects: Materials Science (cond-mat.mtrl-sci); Chemical Physics (physics.chem-ph)

[9]  arXiv:2205.00389 [pdf, ps, other]

Title: Scaling of Berry-curvature monopole dominated large linear positive magnetoresistance

Authors: Shen Zhang, Yibo Wang, Qingqi Zeng, Jianlei Shen, Xinqi Zheng, Jinying Yang, Zhaosheng Wang, Chuanying Xi, Binbin Wang, Min Zhou, Rongjin Huang, Hongxiang Wei, Yuan Yao, Shouguo Wang, Stuart S. P. Parkin, Claudia Felser, Enke Liu, Baogen Shen

Subjects: Materials Science (cond-mat.mtrl-sci)

[10]  arXiv:2205.00447 [pdf, other]

Title: Molecular Identification with Atomic Force Microscopy and Conditional Generative Adversarial Networks

Authors: Jaime Carracedo-Cosme, Rubén Pérez

Comments: 32 pages, 5 figures, includes supplementary information (with additional 11 pages, 3 figures, 1 table)

Subjects: Materials Science (cond-mat.mtrl-sci); Disordered Systems and Neural Networks (cond-mat.dis-nn)

[11]  arXiv:2205.00449 [pdf, other]

Title: Molecular Identification from AFM images using the IUPAC Nomenclature and Attribute Multimodal Recurrent Neural Networks

Authors: Jaime Carracedo-Cosme, Carlos Romero-Muñiz, Pablo Pou, Rubén Pérez

Comments: 30 pages, 4 figures, 2 tables, includes supplementary information (with additional 21 pages, 9 figures, 1 table)

Subjects: Materials Science (cond-mat.mtrl-sci); Disordered Systems and Neural Networks (cond-mat.dis-nn); Machine Learning (cs.LG)

[12]  arXiv:2205.00524 [pdf, other]

Title: Atomic structure of amorphous SiN: combining Car-Parrinello and Born-Oppenheimer first-principles molecular dynamics

Authors: Achille Lambrecht, Carlo Massobrio, Mauro Boero, Guido Ori, Evelyne Martin

Subjects: Materials Science (cond-mat.mtrl-sci)

[13]  arXiv:2205.00537 [pdf, other]

Title: Existence of inter coupled structural, electronic and magnetic states in Sm$ _{2} $NiMnO$ _{6} $ double perovskite

Authors: S. Majumder, M. Tripathi, D. O. de Souza, A. Sagdeo, L. Olivi, M. N. Singh, S. Pal, R. J. Choudhary, D. M. Phase

Comments: 14 pages, 10 figures

Subjects: Materials Science (cond-mat.mtrl-sci)

[14]  arXiv:2205.00552 [pdf, ps, other]

Title: Melting of gold by ultrashort laser pulses: Advanced two-temperature modeling and comparison with surface damage experiments

Authors: Sergey A. Lizunov, Alexander V. Bulgakov, Eleanor E. B. Campbell, Nadezhda M. Bulgakova

Comments: 19 pages, 4 figures

Subjects: Materials Science (cond-mat.mtrl-sci)

[15]  arXiv:2205.00697 [pdf, ps, other]

Title: Hydrogen-induced hardening of a high-manganese twinning induced plasticity steel

Authors: Heena Khanchandani, Dirk Ponge, Stefan Zaefferer, Baptiste Gault

Subjects: Materials Science (cond-mat.mtrl-sci)

[16]  arXiv:2205.00700 [pdf, other]

Title: Twin interaction with $Σ$11 tilt grain boundaries in BCC Fe : Formation of new grain boundaries

Authors: G. Sainath, A. Nagesha

Comments: 15 Pages, 7 Figures, Journal Paper

Journal-ref: Computational Materials Science 210 (2022) 111449

Subjects: Materials Science (cond-mat.mtrl-sci); Mesoscale and Nanoscale Physics (cond-mat.mes-hall); Computational Physics (physics.comp-ph)

[17]  arXiv:2205.00711 [pdf, ps, other]

Title: Electron emission from plasmonically induced Floquet bands at metal surfaces

Authors: Branko Gumhalter, Dino Novko, Hrvoje Petek

Comments: 12 pages, 5 figures

Subjects: Materials Science (cond-mat.mtrl-sci)

[18]  arXiv:2205.00747 [pdf, other]

Title: Chalcogenide Perovskites: An Emerging Class of Semiconductors for Optoelectronics

Authors: Pooja Basera, Saswata Bhattacharya

Journal-ref: J. Phys. Chem. Lett. 2022, 13, 6439-6446

Subjects: Materials Science (cond-mat.mtrl-sci)

[19]  arXiv:2205.00803 [pdf, other]

Title: Metastable states in the J1-J2 Ising model

Authors: V.A. Abalmasov, B.E. Vugmeister

Comments: 10 pages, 5 figures; corresponds to the published version

Journal-ref: Phys. Rev. E 107 (2023) 034124

Subjects: Materials Science (cond-mat.mtrl-sci); Statistical Mechanics (cond-mat.stat-mech)

[20]  arXiv:2205.00826 [pdf, ps, other]

Title: Metastable defects decrease the fill factor of solar cells

Authors: Thomas Paul Weiss, Omar Ramírez, Stefan Paetel, Wolfram Witte, Jiro Nishinaga, Thomas Feurer, Susanne Siebentritt

Subjects: Materials Science (cond-mat.mtrl-sci); Applied Physics (physics.app-ph)

[21]  arXiv:2205.00827 [pdf, ps, other]

Title: Insights on the variability of Cu filament formation in the SiO2 electrolyte of quantized-conductance conductive bridge random access memory devices

Authors: Florian Maudet, Veeresh Deshpande, Catherine Dubourdieu

Subjects: Materials Science (cond-mat.mtrl-sci)

[22]  arXiv:2205.00855 [pdf, other]

Title: Atomic-scale Oxygen-mediated Etching of 2D MoS$_2$ and MoTe$_2$

Authors: E. Harriet Åhlgren, Alexander Markevich, Sophie Scharinger, Bernhard Fickl, Georg Zagler, Felix Herterich, Niall McEvoy, Clemens Mangler, Jani Kotakoski

Comments: 17 pages, 9 figures and 3 tables

Subjects: Materials Science (cond-mat.mtrl-sci); Mesoscale and Nanoscale Physics (cond-mat.mes-hall)

[23]  arXiv:2205.00874 [pdf, ps, other]

Title: Family of Two Dimensional Transition Metal Dichlorides Fundamental Properties, Structural Defects, and Environmental Stability

Authors: Andrey A. Kistanov, Stepan A. Shcherbinin, Romain Botella, Artur Davletshin, Wei Cao

Subjects: Materials Science (cond-mat.mtrl-sci); Machine Learning (cs.LG); Applied Physics (physics.app-ph)

[24]  arXiv:2205.00959 [pdf, other]

Title: Tuning the domain wall conductivity in bulk lithium niobate by uniaxial stress

Authors: Ekta Singh, Henrik Beccard, Zeeshan H. Amber, Julius Ratzenberger, Clifford W. Hicks, Michael Rüsing, Lukas M. Eng

Subjects: Materials Science (cond-mat.mtrl-sci)

[25]  arXiv:2205.01176 [pdf, ps, other]

Title: Ultrafast imaging of polariton propagation and interactions

Authors: Ding Xu, Arkajit Mandal, James M. Baxter, Shan-Wen Cheng, Inki Lee, Haowen Su, Song Liu, David R. Reichman, Milan Delor

Subjects: Materials Science (cond-mat.mtrl-sci); Optics (physics.optics)

[26]  arXiv:2205.01177 [pdf, ps, other]

Title: Structural lubricity of physisorbed gold clusters on graphite and its breakdown: Role of boundary conditions and contact lines

Authors: Hongyu Gao, Martin H. Müser

Subjects: Materials Science (cond-mat.mtrl-sci)

[27]  arXiv:2205.01194 [pdf, ps, other]

Title: Time-resolved vibrational-pump visible-probe spectroscopy for thermal conductivity measurement of metal-halide perovskites

Authors: Shunran Li, Zhenghong Dai, Linda Li, Nitin P. Padture, Peijun Guo

Journal-ref: Rev. Sci. Instrum. 93, 053003 (2022)

Subjects: Materials Science (cond-mat.mtrl-sci)

[28]  arXiv:2205.01207 [pdf, other]

Title: Perturbation theory and thermal transport in mass-disordered alloys: Insights from Green's function methods

Authors: Simon Thébaud, Tom Berlijn, Lucas Lindsay

Journal-ref: Phys. Rev. B 105, 134202 (2022)

Subjects: Materials Science (cond-mat.mtrl-sci)

[29]  arXiv:2205.01209 [pdf, other]

Title: Machine Learning Interatomic Potential for Simulations of Carbon at Extreme Conditions

Authors: Jonathan T. Willman, Kien Nguyen-Cong, Ashley S. Williams, Anatoly B. Belonoshko, Stan G. Moore, Aidan P. Thompson, Mitchell A. Wood, Ivan I. Oleynik

Subjects: Materials Science (cond-mat.mtrl-sci)

[30]  arXiv:2205.01250 [pdf, other]

Title: First Principle Study for Optical Properties of TMDC/Graphene Heterostructures

Authors: Cheng-Hsien Yang, Shu-Tong Chang

Journal-ref: Photonics 9, 387 (2022)

Subjects: Materials Science (cond-mat.mtrl-sci)

[31]  arXiv:2205.01264 [pdf, other]

Title: The Resistive Nature of Decomposing Interfaces of Solid Electrolytes with Alkali Metal Electrodes

Authors: Juefan Wang, Abhishek A. Panchal, Gopalakrishnan Sai Gautam, Pieremanuele Canepa

Journal-ref: J. Mater. Chem. A, 10, 19732-19742 (2022)

Subjects: Materials Science (cond-mat.mtrl-sci); Disordered Systems and Neural Networks (cond-mat.dis-nn)

[32]  arXiv:2205.01368 [pdf, other]

Title: High-pressure II-III phase transition in solid hydrogen: Insights from state-of-the-art ab initio calculations

Authors: Maria Hellgren, Damian Contant, Thomas Pitts, Michele Casula

Comments: 7 pages, 4 figures + Supplemental Materials (10 pages), to appear in Physical Review Research

Subjects: Materials Science (cond-mat.mtrl-sci)

[33]  arXiv:2205.01384 [pdf, ps, other]

Title: A First-principles study on ABBr3 (A = Cs, Rb, K, Na; B = Ge, Sn) halide perovskites for photovoltaic applications

Authors: Dibyajyoti Saikia, Mahfooz Alam, Jayanta Bera, Atanu Betal, Appala Naidu Gandhi, Satyajit Sahu

Comments: 25 pages, 11 figures, 5 tables

Subjects: Materials Science (cond-mat.mtrl-sci)

[34]  arXiv:2205.01408 [pdf, ps, other]

Title: Tuning the perpendicular anisotropy of ferromagnetic films by thickness, width, and profile

Authors: Gregory Kopnov, Alexander Gerber

Journal-ref: Appl. Phys. Lett. 120, 182401 (2022)

Subjects: Materials Science (cond-mat.mtrl-sci)

[35]  arXiv:2205.01452 [pdf, other]

Title: On the Issue of Textured Crystallization of Ba(NO$_3$)$_2$ in Mesoporous SiO$_2$: Raman Spectroscopy and Lattice Dynamics Analysis

Authors: Yaroslav Shchur, Guillermo Beltramo, Anatolii S. Andrushchak, Svetlana Vitusevich, Patrick Huber, Volodymyr Adamiv, Ihor Teslyuk, Nazarii Boichuk, Andriy V. Kityk

Comments: 12 pages, 9 figures, as submitted

Journal-ref: Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 275, 121157 (2022)

Subjects: Materials Science (cond-mat.mtrl-sci); Mesoscale and Nanoscale Physics (cond-mat.mes-hall); Applied Physics (physics.app-ph); Chemical Physics (physics.chem-ph); Optics (physics.optics)

[36]  arXiv:2205.01468 [pdf, ps, other]

Title: Layer-by-layer growth of bilayer graphene single-crystals enabled by self-transmitting catalytic activity

Authors: Zhihong Zhang, Linwei Zhou, Zhaoxi Chen, Antonín Jaroš, Miroslav Kolíbal, Petr Bábor, Quanzhen Zhang, Changlin Yan, Ruixi Qiao, Qing Zhang, Teng Zhang, Wei Wei, Yi Cui, Jingsi Qiao, Liwei Liu, Lihong Bao, Haitao Yang, Zhihai Cheng, Yeliang Wang, Enge Wang, Zhi Liu, Marc Willinger, Hong-Jun Gao, Kaihui Liu, Zhu-Jun Wang, Wei Ji

Comments: 5 figures and 9 extended figures

Subjects: Materials Science (cond-mat.mtrl-sci); Mesoscale and Nanoscale Physics (cond-mat.mes-hall)

[37]  arXiv:2205.01504 [pdf, other]

Title: Modeling directional hardening and intrinsic size effects using a dislocation density-based strain gradient plasticity framework

Authors: Anirban Patra, Namit Pai, Parhitosh Sharma

Comments: 21 pages, 11 figures

Subjects: Materials Science (cond-mat.mtrl-sci)

[38]  arXiv:2205.01520 [pdf, other]

Title: Mapping Thermoelectric Transport in a Multicomponent Alloy Space

Authors: Ramya Gurunathan, Suchismita Sarker, Christopher K.H. Borg, James Saal, Logan Ward, Apurva Mehta, G. Jeffrey Snyder

Subjects: Materials Science (cond-mat.mtrl-sci)

[39]  arXiv:2205.01559 [pdf, ps, other]

Title: A study on rare-earth Laves phases for magnetocaloric liquefaction of hydrogen

Authors: Wei Liu, Eduard Bykov, Sergey Taskaev, Mikhail Bogush, Vladimir Khovaylo, Nuno Fortunato, Alex Aubert, Hongbin Zhang, Tino Gottschall, Jochen Wosniza, Franziska Scheibel, Konstantin Skokov, Oliver Gutfleisch

Subjects: Materials Science (cond-mat.mtrl-sci); Applied Physics (physics.app-ph)

[40]  arXiv:2205.01622 [pdf, other]

Title: Magnetic freeze-out and anomalous Hall effect in ZrTe$_5$

Authors: Adrien Gourgout, Maxime Leroux, Jean-Loup Smirr, Maxime Massoudzadegan, Ricardo P. S. M. Lobo, David Vignolles, Cyril Proust, Helmuth Berger, Qiang Li, Genga Gu, Christopher C. Homes, Ana Akrap, Benoît Fauqué

Comments: 14 pages, 4 figures

Subjects: Materials Science (cond-mat.mtrl-sci); Strongly Correlated Electrons (cond-mat.str-el)

[41]  arXiv:2205.01880 [pdf, ps, other]

Title: Surface states induced weak anti-localization effect in Bi0.85Sb0.15 topological single crystal

Authors: Yogesh Kumar, VPS Awana (CSIR-NPL)

Comments: 19 Pages Text + Figs. Accepted Mat. Res. Express (2022)

Subjects: Materials Science (cond-mat.mtrl-sci); Strongly Correlated Electrons (cond-mat.str-el)

[42]  arXiv:2205.01913 [pdf, ps, other]

Title: Ionic Bonds Control Ferroelectric Behavior in Wurtzite Nitrides

Authors: Keisuke Yazawa, John Mangum, Prashun Gorai, Geoff L. Brennecka, Andriy Zakutayev

Subjects: Materials Science (cond-mat.mtrl-sci)

[43]  arXiv:2205.01963 [pdf, ps, other]

Title: Reliable and Broad-range Layer Identification of Au-assisted Exfoliated Large Area MoS$_2$ and WS$_2$ Using Reflection Spectroscopic Fingerprints

Authors: Bo Zou, Yu Zhou, Yan Zhou, Yanyan Wu, Yang He, Xiaonan Wang, Jinfeng Yang, Lianghui Zhang, Yuxiang Chen, Shi Zhou, Huaixin Guo, Huarui Sun

Subjects: Materials Science (cond-mat.mtrl-sci)

[44]  arXiv:2205.01994 [pdf, other]

Title: Two-dimensional Obstructed Atomic Insulators with Fractional Corner Charge in MA$_2$Z$_4$ Family

Authors: Lei Wang, Yi Jiang, Jiaxi Liu, Shuai Zhang, Jiangxu Li, Peitao Liu, Yan Sun, Hongming Weng, Xing-Qiu Chen

Comments: 13 pages, 10 figures and 6 tables

Subjects: Materials Science (cond-mat.mtrl-sci)

[45]  arXiv:2205.02011 [pdf, other]

Title: Exchange bias in Sm$ _{2} $NiMnO$ _{6}$/BaTiO$ _{3}$ ferromagnetic-diamagnetic heterostructure thin films

Authors: S. Majumder, S. Chowdhury, B. K. De, V. Dwij, V. Sathe, D. M. Phase, R. J. Choudhary

Comments: 11 pages, 3 figures

Subjects: Materials Science (cond-mat.mtrl-sci)

[46]  arXiv:2205.02062 [pdf, ps, other]

Title: Mechanical coupling effects of 2D lattices uncovered by decoupled micropolar elasticity tensor and symmetry operation

Authors: Zhiming Cui, Jaehyung Ju

Subjects: Materials Science (cond-mat.mtrl-sci)

[47]  arXiv:2205.02121 [pdf, other]

Title: Accelerating phase-field-based simulation via machine learning

Authors: Iman Peivaste, Nima H. Siboni, Ghasem Alahyarizadeh, Reza Ghaderi, Bob Svendsen, Dierk Raabe, Jaber R. Mianroodi

Subjects: Materials Science (cond-mat.mtrl-sci); Machine Learning (cs.LG); Computational Physics (physics.comp-ph)

[48]  arXiv:2205.02175 [pdf, other]

Title: Band structure of molybdenum disulfide: from first principle to analytical band model

Authors: Cheng-Hsien Yang, Yun-Fang Chung, Yen-Shuo Su, Kuan-Ting Chen, Yi-Sheng Huang, Shu-Tong Chang

Journal-ref: J. Comput. Electron. 21, 571-581 (2022)

Subjects: Materials Science (cond-mat.mtrl-sci)

[49]  arXiv:2205.02179 [pdf, ps, other]

Title: Measurements and Numerical Calculations of Thermal Conductivity to Evaluate the Quality of β-Gallium Oxide Thin Films Grown on Sapphire and Silicon Carbide by Molecular Beam Epitaxy

Authors: Diego Vaca (1), Matthew Barry (1), Luke Yates (2), Neeraj Nepal (3), D. Scott Katzer (3), Brian P. Downey (3), Virginia Wheeler (3), Luke Nyakiti (4), David J. Meyer (3), Samuel Graham (5), Satish Kumar (1) ((1). School of Mechanical Engineering, Georgia Institute of Technology, Atlanta, GA 30332, USA (2). Sandia National Laboratories, Albuquerque, NM 87185, USA (3). U.S. Naval Research Laboratory, Washington, DC 20375, USA (4). Department of Material Science and Engineering & Marine Engineering and Technology, Texas A&M University, College Station, TX 77843, USA (5). School of Engineering, University of Maryland, College Park, MD 20742, USA)

Comments: 11 pages. Includes supplementary Information. The following article has been submitted to Applied Physics Letters. After it is published, it will be found at this https URL

Subjects: Materials Science (cond-mat.mtrl-sci); Applied Physics (physics.app-ph)

[50]  arXiv:2205.02185 [pdf, other]

Title: Hole Mobility Calculation for Monolayer Molybdenum Tungsten Alloy Disulfide

Authors: Ming-Ting Wu, Cheng-Hsien Yang, Yun-Fang Chung, Kuan-Ting Chen, Shu-Tong Chang

Journal-ref: Journal of Nanoscience and Nanotechnology 20, 7175 (2020)

Subjects: Materials Science (cond-mat.mtrl-sci)