First-Principles Study on Evolution of Magnetic Domain in Two-Dimensional BaTiO3 Ultrathin Film Doped with Co under Electric Field
The magnetization mechanism of Co-doped BaTiO3 ultrathin films is a subject of debate, which results in difficulties with the design of new multiferroics based on BaTiO3 matrixes. With the aid of a first-principles approach, it was observed that when the interstitial site and Ti vacancy were filled...
Saved in:
| Published in | Nanomaterials (Basel, Switzerland) Vol. 14; no. 7; p. 586 |
|---|---|
| Main Authors | , , , , |
| Format | Journal Article |
| Language | English |
| Published |
Basel
MDPI AG
01.04.2024
|
| Subjects | |
| Online Access | Get full text |
Cover
Loading…
| Abstract | The magnetization mechanism of Co-doped BaTiO3 ultrathin films is a subject of debate, which results in difficulties with the design of new multiferroics based on BaTiO3 matrixes. With the aid of a first-principles approach, it was observed that when the interstitial site and Ti vacancy were filled with Co, the configuration behaved in a nonmagnetic manner, indicating the significance of the Co content. Moreover, in the case of Co substituting two neighboring Ti atoms, when a direct current field was applied in the [100] direction, the magnetic domains excluding those in the [100], [010], and [001] directions were directed away. Further, the magnetoelectric constant was evaluated at ~449.3 mV/cmOe, showing strong magnetoelectric coupling at room temperature. Clearly, our study indicates that strict control of Ba, Ti, O, and Co stoichiometry can induce an electric and magnetic field conversion in two-dimensional BaTiO3 and may provide a new candidate for single-phase multiferroics for application in next-generation multifunctional devices. |
|---|---|
| AbstractList | The magnetization mechanism of Co-doped BaTiO3 ultrathin films is a subject of debate, which results in difficulties with the design of new multiferroics based on BaTiO3 matrixes. With the aid of a first-principles approach, it was observed that when the interstitial site and Ti vacancy were filled with Co, the configuration behaved in a nonmagnetic manner, indicating the significance of the Co content. Moreover, in the case of Co substituting two neighboring Ti atoms, when a direct current field was applied in the [100] direction, the magnetic domains excluding those in the [100], [010], and [001] directions were directed away. Further, the magnetoelectric constant was evaluated at ~449.3 mV/cmOe, showing strong magnetoelectric coupling at room temperature. Clearly, our study indicates that strict control of Ba, Ti, O, and Co stoichiometry can induce an electric and magnetic field conversion in two-dimensional BaTiO3 and may provide a new candidate for single-phase multiferroics for application in next-generation multifunctional devices.The magnetization mechanism of Co-doped BaTiO3 ultrathin films is a subject of debate, which results in difficulties with the design of new multiferroics based on BaTiO3 matrixes. With the aid of a first-principles approach, it was observed that when the interstitial site and Ti vacancy were filled with Co, the configuration behaved in a nonmagnetic manner, indicating the significance of the Co content. Moreover, in the case of Co substituting two neighboring Ti atoms, when a direct current field was applied in the [100] direction, the magnetic domains excluding those in the [100], [010], and [001] directions were directed away. Further, the magnetoelectric constant was evaluated at ~449.3 mV/cmOe, showing strong magnetoelectric coupling at room temperature. Clearly, our study indicates that strict control of Ba, Ti, O, and Co stoichiometry can induce an electric and magnetic field conversion in two-dimensional BaTiO3 and may provide a new candidate for single-phase multiferroics for application in next-generation multifunctional devices. The magnetization mechanism of Co-doped BaTiO3 ultrathin films is a subject of debate, which results in difficulties with the design of new multiferroics based on BaTiO3 matrixes. With the aid of a first-principles approach, it was observed that when the interstitial site and Ti vacancy were filled with Co, the configuration behaved in a nonmagnetic manner, indicating the significance of the Co content. Moreover, in the case of Co substituting two neighboring Ti atoms, when a direct current field was applied in the [100] direction, the magnetic domains excluding those in the [100], [010], and [001] directions were directed away. Further, the magnetoelectric constant was evaluated at ~449.3 mV/cmOe, showing strong magnetoelectric coupling at room temperature. Clearly, our study indicates that strict control of Ba, Ti, O, and Co stoichiometry can induce an electric and magnetic field conversion in two-dimensional BaTiO3 and may provide a new candidate for single-phase multiferroics for application in next-generation multifunctional devices. |
| Author | Wang, Bing Tang, Yu Zhao, Xiangyu Liao, Qilong Gao, Haigen |
| Author_xml | – sequence: 1 givenname: Haigen surname: Gao fullname: Gao, Haigen – sequence: 2 givenname: Yu surname: Tang fullname: Tang, Yu – sequence: 3 givenname: Qilong surname: Liao fullname: Liao, Qilong – sequence: 4 givenname: Xiangyu surname: Zhao fullname: Zhao, Xiangyu – sequence: 5 givenname: Bing surname: Wang fullname: Wang, Bing |
| BookMark | eNpdkU1r3DAQhk1JoWmaW3-AoJce6lbySJZ8bDe7TSAlhW7ORrbGiRZZ2kpyQq795VWyoYQOA_MyPLzMx9vqyAePVfWe0c8AHf3itQ-MU0mFal9Vxw2VXc27jh290G-q05R2tETHQAk4rv5sbEy5_hmtH-3eYSK_8mIeSPBkfRfckm1RYSI_9I3HbEdyFmZtPSm5vQ_1mZ3Rp8JoR77prb0Ccu1y1Pm2ABvr5sLv0ZB7m2_JKpDFG4xk7XDMsZhtLDrzrno9aZfw9LmeVNeb9XZ1Xl9efb9Yfb2sRxAy18ZwqiQFqSY-SQDsJGOq0QZEw9uJs4YpxYSi1AxjA4igBRtoNwhgU8MnOKkuDr4m6F2_j3bW8aEP2vZPjRBveh3Lig77oRW0pZJPYjC8pVwJjh2KtjVKCaUevT4evPYx_F4w5X62aUTntMewpB4oKA4t8KagH_5Dd2GJ5WBPlORCKNEW6tOBGmNIKeL0b0BG-8f_9i__C38ByYCXqw |
| Cites_doi | 10.1007/s00339-012-7109-x 10.1016/j.ceramint.2016.05.021 10.1088/0022-3727/46/4/045307 10.1126/science.1080615 10.1021/acs.nanolett.8b04326 10.1103/PhysRevB.79.172103 10.1103/PhysRevB.48.4442 10.3390/nano9020269 10.1039/c3ta11845b 10.1103/PhysRevB.83.104107 10.1016/j.ceramint.2019.09.208 10.1103/PhysRevB.90.054106 10.1103/PhysRevB.81.144116 10.1103/PhysRevB.45.13244 10.1016/j.ijleo.2015.10.240 10.1063/1.4907182 10.1016/j.matchemphys.2008.01.020 10.1016/0927-0256(96)00008-0 10.1063/1.5134494 10.1016/j.saa.2016.07.037 10.1016/j.physb.2014.09.046 10.1103/PhysRevB.47.1651 10.1038/s41467-018-05640-4 10.1103/PhysRevLett.116.106101 10.1063/1.3182793 10.1016/j.intermet.2009.03.017 10.1007/s10971-018-4835-3 10.1007/s10948-017-4321-0 10.1016/S0038-1098(02)00087-X 10.1103/PhysRevB.73.045112 10.3390/ma16247528 10.1039/D0CP01968B 10.1038/asiamat.2010.32 10.1016/j.jnucmat.2010.06.029 10.1021/acsami.1c25069 10.1103/PhysRevB.94.205121 10.1016/j.ssc.2014.04.001 10.1038/s41563-018-0204-4 10.1103/PhysRevB.54.11169 10.1002/adma.201003636 10.1103/RevModPhys.64.1045 10.1016/j.ceramint.2020.07.219 10.1063/1.2898525 10.1016/j.matchar.2016.09.015 10.1016/S0167-577X(97)00161-4 10.1103/PhysRevB.13.5188 |
| ContentType | Journal Article |
| Copyright | 2024 by the authors. Licensee MDPI, Basel, Switzerland. This article is an open access article distributed under the terms and conditions of the Creative Commons Attribution (CC BY) license (https://creativecommons.org/licenses/by/4.0/). Notwithstanding the ProQuest Terms and Conditions, you may use this content in accordance with the terms of the License. |
| Copyright_xml | – notice: 2024 by the authors. Licensee MDPI, Basel, Switzerland. This article is an open access article distributed under the terms and conditions of the Creative Commons Attribution (CC BY) license (https://creativecommons.org/licenses/by/4.0/). Notwithstanding the ProQuest Terms and Conditions, you may use this content in accordance with the terms of the License. |
| DBID | AAYXX CITATION 7QF 7QO 7QQ 7SC 7SE 7SP 7SR 7TA 7TB 7U5 8BQ 8FD 8FE 8FG 8FH ABJCF ABUWG AFKRA AZQEC BBNVY BENPR BGLVJ BHPHI CCPQU D1I DWQXO F28 FR3 GNUQQ H8D H8G HCIFZ JG9 JQ2 KB. KR7 L7M LK8 L~C L~D M7P P64 PDBOC PHGZM PHGZT PIMPY PKEHL PQEST PQGLB PQQKQ PQUKI PRINS 7X8 DOA |
| DOI | 10.3390/nano14070586 |
| DatabaseName | CrossRef Aluminium Industry Abstracts Biotechnology Research Abstracts Ceramic Abstracts Computer and Information Systems Abstracts Corrosion Abstracts Electronics & Communications Abstracts Engineered Materials Abstracts Materials Business File Mechanical & Transportation Engineering Abstracts Solid State and Superconductivity Abstracts METADEX Technology Research Database ProQuest SciTech Collection ProQuest Technology Collection ProQuest Natural Science Collection Materials Science & Engineering Collection ProQuest Central (Alumni) ProQuest Central UK/Ireland ProQuest Central Essentials ProQuest : Biological Science Collection journals [unlimited simultaneous users] ProQuest Central - New (Subscription) Technology Collection ProQuest Natural Science Collection ProQuest One Community College ProQuest Materials Science Collection ProQuest Central ANTE: Abstracts in New Technology & Engineering Engineering Research Database ProQuest Central Student Aerospace Database Copper Technical Reference Library SciTech Premium Collection Materials Research Database ProQuest Computer Science Collection Materials Science Database Civil Engineering Abstracts Advanced Technologies Database with Aerospace ProQuest Biological Science Collection Computer and Information Systems Abstracts Academic Computer and Information Systems Abstracts Professional Biological Science Database Biotechnology and BioEngineering Abstracts Materials Science Collection ProQuest Central Premium ProQuest One Academic Publicly Available Content Database ProQuest One Academic Middle East (New) ProQuest One Academic Eastern Edition (DO NOT USE) ProQuest One Applied & Life Sciences ProQuest One Academic ProQuest One Academic UKI Edition ProQuest Central China MEDLINE - Academic DOAJ (Directory of Open Access Journals) |
| DatabaseTitle | CrossRef Publicly Available Content Database Materials Research Database ProQuest Central Student ProQuest Central Essentials ProQuest Computer Science Collection Computer and Information Systems Abstracts SciTech Premium Collection ProQuest Central China Materials Business File ProQuest One Applied & Life Sciences Engineered Materials Abstracts Natural Science Collection Biological Science Collection ProQuest Central (New) ANTE: Abstracts in New Technology & Engineering Aluminium Industry Abstracts ProQuest Biological Science Collection ProQuest One Academic Eastern Edition Electronics & Communications Abstracts ProQuest Technology Collection Ceramic Abstracts Biological Science Database Biotechnology and BioEngineering Abstracts ProQuest One Academic UKI Edition Solid State and Superconductivity Abstracts Engineering Research Database ProQuest One Academic ProQuest One Academic (New) Technology Collection Technology Research Database Computer and Information Systems Abstracts – Academic ProQuest One Academic Middle East (New) Mechanical & Transportation Engineering Abstracts Materials Science Collection ProQuest Central (Alumni Edition) ProQuest One Community College ProQuest Natural Science Collection ProQuest Central Aerospace Database Copper Technical Reference Library Biotechnology Research Abstracts ProQuest Central Korea Materials Science Database Advanced Technologies Database with Aerospace ProQuest Materials Science Collection Civil Engineering Abstracts ProQuest SciTech Collection METADEX Computer and Information Systems Abstracts Professional Materials Science & Engineering Collection Corrosion Abstracts MEDLINE - Academic |
| DatabaseTitleList | MEDLINE - Academic Publicly Available Content Database CrossRef |
| Database_xml | – sequence: 1 dbid: DOA name: DOAJ Directory of Open Access Journals url: https://www.doaj.org/ sourceTypes: Open Website – sequence: 2 dbid: 8FG name: ProQuest Technology Collection url: https://search.proquest.com/technologycollection1 sourceTypes: Aggregation Database |
| DeliveryMethod | fulltext_linktorsrc |
| Discipline | Engineering |
| EISSN | 2079-4991 |
| ExternalDocumentID | oai_doaj_org_article_b6506074f5bd4604854e9e566d88588f 10_3390_nano14070586 |
| GroupedDBID | 53G 5VS 8FE 8FG 8FH AADQD AAFWJ AAHBH AAYXX ABJCF ADBBV ADMLS AENEX AFKRA AFPKN AFZYC ALMA_UNASSIGNED_HOLDINGS AOIJS BBNVY BCNDV BENPR BGLVJ BHPHI CCPQU CITATION D1I GROUPED_DOAJ HCIFZ HYE I-F IAO ITC KB. KQ8 LK8 M7P MODMG M~E OK1 PDBOC PGMZT PHGZM PHGZT PIMPY PROAC RPM 7QF 7QO 7QQ 7SC 7SE 7SP 7SR 7TA 7TB 7U5 8BQ 8FD ABUWG AZQEC DWQXO F28 FR3 GNUQQ H8D H8G JG9 JQ2 KR7 L7M L~C L~D P64 PKEHL PQEST PQGLB PQQKQ PQUKI PRINS 7X8 PUEGO |
| ID | FETCH-LOGICAL-c357t-dd40870378f4f733e971182ad35246f41218815800dbc23ee3a51b09b531f24f3 |
| IEDL.DBID | BENPR |
| ISSN | 2079-4991 |
| IngestDate | Wed Aug 27 01:27:25 EDT 2025 Thu Jul 10 18:15:07 EDT 2025 Fri Jul 25 09:36:43 EDT 2025 Tue Jul 01 00:51:47 EDT 2025 |
| IsDoiOpenAccess | true |
| IsOpenAccess | true |
| IsPeerReviewed | true |
| IsScholarly | true |
| Issue | 7 |
| Language | English |
| License | https://creativecommons.org/licenses/by/4.0 |
| LinkModel | DirectLink |
| MergedId | FETCHMERGED-LOGICAL-c357t-dd40870378f4f733e971182ad35246f41218815800dbc23ee3a51b09b531f24f3 |
| Notes | ObjectType-Article-1 SourceType-Scholarly Journals-1 ObjectType-Feature-2 content type line 14 content type line 23 |
| OpenAccessLink | https://www.proquest.com/docview/3037455856?pq-origsite=%requestingapplication% |
| PQID | 3037455856 |
| PQPubID | 2032354 |
| ParticipantIDs | doaj_primary_oai_doaj_org_article_b6506074f5bd4604854e9e566d88588f proquest_miscellaneous_3038436342 proquest_journals_3037455856 crossref_primary_10_3390_nano14070586 |
| ProviderPackageCode | CITATION AAYXX |
| PublicationCentury | 2000 |
| PublicationDate | 2024-04-01 |
| PublicationDateYYYYMMDD | 2024-04-01 |
| PublicationDate_xml | – month: 04 year: 2024 text: 2024-04-01 day: 01 |
| PublicationDecade | 2020 |
| PublicationPlace | Basel |
| PublicationPlace_xml | – name: Basel |
| PublicationTitle | Nanomaterials (Basel, Switzerland) |
| PublicationYear | 2024 |
| Publisher | MDPI AG |
| Publisher_xml | – name: MDPI AG |
| References | Shah (ref_24) 2013; 1 Gao (ref_14) 2020; 22 Phan (ref_21) 2015; 117 Rajan (ref_17) 2017; 171 Kresse (ref_27) 1996; 6 Lee (ref_26) 2019; 19 Samuvel (ref_18) 2016; 127 Shimada (ref_46) 2010; 81 Roch (ref_10) 2016; 120 ref_30 Lin (ref_23) 2009; 95 Zhang (ref_41) 2009; 17 Duan (ref_43) 2010; 404 Harizanov (ref_45) 1998; 34 Vanderbilt (ref_33) 1993; 48 Yeh (ref_35) 2021; 11 Khirade (ref_13) 2016; 42 Monkhorst (ref_31) 1976; 13 Arshad (ref_11) 2020; 46 Madhan (ref_12) 2018; 88 Lin (ref_16) 2008; 92 Wang (ref_6) 2003; 299 Dang (ref_20) 2015; 457 Xiao (ref_37) 2008; 209 Ma (ref_48) 2011; 23 Gao (ref_40) 2020; 127 Payne (ref_29) 1992; 64 Li (ref_38) 2014; 90 Santos (ref_7) 2002; 122 Perdew (ref_28) 1992; 45 Li (ref_1) 2018; 9 Wang (ref_9) 2018; 17 Arshad (ref_3) 2020; 46 Gao (ref_4) 2013; 46 ref_44 Wang (ref_47) 2010; 2 Vanderbilt (ref_32) 1993; 47 Hummer (ref_34) 2006; 73 Cao (ref_2) 2022; 14 Kumah (ref_36) 2016; 116 Gao (ref_5) 2012; 109 Kresse (ref_25) 1996; 54 Ducher (ref_39) 2011; 83 ref_8 Das (ref_22) 2014; 191 Ponath (ref_15) 2016; 94 Liu (ref_42) 2009; 79 Deka (ref_19) 2018; 31 |
| References_xml | – volume: 109 start-page: 331 year: 2012 ident: ref_5 article-title: Field-induced domain switching in BaTiO3-based multilayer ceramic capacitors observed by polarized Raman spectroscopy publication-title: Appl. Phys. A doi: 10.1007/s00339-012-7109-x – volume: 42 start-page: 12441 year: 2016 ident: ref_13 article-title: Multiferroic iron doped BaTiO3 nanoceramics synthesized by sol-gel auto combustion: Influence of iron on physical properties publication-title: Ceram. Int. doi: 10.1016/j.ceramint.2016.05.021 – ident: ref_30 – volume: 46 start-page: 045307 year: 2013 ident: ref_4 article-title: Influence of thickness on the electrical properties of BaTiO3 films deposited on Ni substrates by radio-frequency magnetron sputtering publication-title: J. Phys. D Appl. Phys. doi: 10.1088/0022-3727/46/4/045307 – volume: 299 start-page: 1719 year: 2003 ident: ref_6 article-title: Epitaxial BiFeO3 multiferroic thin film heterostructures publication-title: Science doi: 10.1126/science.1080615 – volume: 11 start-page: 33276 year: 2021 ident: ref_35 article-title: Effects of external electric field on the sensing property of volatile organic compounds over Janus MoSSe monolayer: A first-principles investigation publication-title: Advances – volume: 19 start-page: 2243 year: 2019 ident: ref_26 article-title: First observation of ferroelectricity in #1 nm ultra-thin semiconducting BaTiO3 films publication-title: Nano Lett. doi: 10.1021/acs.nanolett.8b04326 – volume: 79 start-page: 172103 year: 2009 ident: ref_42 article-title: Vacancy trapping mechanism for hydrogen bubble formation in metal publication-title: Phys. Rev. B doi: 10.1103/PhysRevB.79.172103 – volume: 48 start-page: 4442 year: 1993 ident: ref_33 article-title: Electric polarization as a bulk quantity and its relation to surface charge publication-title: Phys. Rev. B doi: 10.1103/PhysRevB.48.4442 – ident: ref_8 doi: 10.3390/nano9020269 – volume: 1 start-page: 8601 year: 2013 ident: ref_24 article-title: Induced magnetism and magnetoelectric coupling in ferroelectric BaTiO3 by Cr-doping synthesized by a facile chemical route publication-title: J. Mater. Chem. doi: 10.1039/c3ta11845b – volume: 83 start-page: 104107 year: 2011 ident: ref_39 article-title: First-principles study of defect behavior in irradiated uranium monocarbide publication-title: Phys. Rev. B doi: 10.1103/PhysRevB.83.104107 – volume: 46 start-page: 2238 year: 2020 ident: ref_3 article-title: Fabrication, structure, and frequency-dependent electrical and dielectric properties of Sr-doped BaTiO3 ceramics publication-title: Ceram. Int. doi: 10.1016/j.ceramint.2019.09.208 – volume: 90 start-page: 054106 year: 2014 ident: ref_38 article-title: First-principles study of 180 degrees domain walls in BaTiO3: Mixed Bloch-Neel-Ising character publication-title: Phys. Rev. B doi: 10.1103/PhysRevB.90.054106 – volume: 81 start-page: 144116 year: 2010 ident: ref_46 article-title: Ab initio study of ferroelectric closure domains in ultrathin PbTiO3 films publication-title: Phys. Rev. B doi: 10.1103/PhysRevB.81.144116 – volume: 45 start-page: 13244 year: 1992 ident: ref_28 article-title: Accurate and simple analytic representation of the electron gas correlation energy publication-title: Phys. Rev. B doi: 10.1103/PhysRevB.45.13244 – volume: 127 start-page: 1781 year: 2016 ident: ref_18 article-title: Structure, electrical and magnetic property investigations on Fe-doped hexagonal BaTiO3 publication-title: Optik doi: 10.1016/j.ijleo.2015.10.240 – volume: 117 start-page: 17D904 year: 2015 ident: ref_21 article-title: Local geometric and electronic structures and origin of magnetism in Co-doped BaTiO3 multiferroics publication-title: J. Appl. Phys. doi: 10.1063/1.4907182 – volume: 209 start-page: 209 year: 2008 ident: ref_37 article-title: Crystal structure of dense nanocrystalline BaTiO3 ceramics publication-title: Mater. Chem. Phys. doi: 10.1016/j.matchemphys.2008.01.020 – volume: 6 start-page: 15 year: 1996 ident: ref_27 article-title: Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set publication-title: Comput. Mater. Sci. doi: 10.1016/0927-0256(96)00008-0 – volume: 127 start-page: 175109 year: 2020 ident: ref_40 article-title: A first-principles study of damage induced by gaseous species He, Kr, and Xe on the structure of nuclear fuel, U3Si publication-title: J. Appl. Phys. doi: 10.1063/1.5134494 – volume: 171 start-page: 80 year: 2017 ident: ref_17 article-title: Impact of Fe on structural modifification and room temperature magnetic ordering in BaTiO3 publication-title: Spectrochim. Acta Part A Mol. Biomol. Spectrosc. doi: 10.1016/j.saa.2016.07.037 – volume: 457 start-page: 103 year: 2015 ident: ref_20 article-title: Effect of Fe3+ substitution on structural, optical and magnetic properties of barium titanate ceramics publication-title: Phys. B Condens. Matter doi: 10.1016/j.physb.2014.09.046 – volume: 47 start-page: 1651 year: 1993 ident: ref_32 article-title: Theory of polarization of crystalline solids publication-title: Phys. Rev. B doi: 10.1103/PhysRevB.47.1651 – volume: 9 start-page: 3344 year: 2018 ident: ref_1 article-title: Optical control of polarization in ferroelectric heterostructures publication-title: Nat. Commun. doi: 10.1038/s41467-018-05640-4 – volume: 116 start-page: 106101 year: 2016 ident: ref_36 article-title: Engineered Unique Elastic Modes at a BaTiO3/(2×1)-Ge(001) Interface publication-title: Phys. Rev. Lett. doi: 10.1103/PhysRevLett.116.106101 – volume: 95 start-page: 033105 year: 2009 ident: ref_23 article-title: Multiferroic behavior observed in highly orientated Mn-doped thin films publication-title: Appl. Phys. Lett. doi: 10.1063/1.3182793 – volume: 17 start-page: 878 year: 2009 ident: ref_41 article-title: Enthalpies of formation of magnesium compounds from first-principles calculations publication-title: Intermetallics doi: 10.1016/j.intermet.2009.03.017 – volume: 88 start-page: 584 year: 2018 ident: ref_12 article-title: Investigations on the phase transition of Mn-doped BaTiO3 multifunctional ferroelectric ceramics through Raman, dielectric, and magnetic studies publication-title: J. Sol-Gel Sci. Technol. doi: 10.1007/s10971-018-4835-3 – volume: 31 start-page: 1427 year: 2018 ident: ref_19 article-title: Ferromagnetism in Fe-doped BaTiO3 Ceramics publication-title: J. Supercond. Nov. Magn. doi: 10.1007/s10948-017-4321-0 – volume: 122 start-page: 49 year: 2002 ident: ref_7 article-title: Evidence for the likely occurrence of magneto ferroelectricity in the simple perovskite, BiMnO3 publication-title: Solid State Commun. doi: 10.1016/S0038-1098(02)00087-X – volume: 73 start-page: 045112 year: 2006 ident: ref_34 article-title: Linear optical properties in the projector-augmented wave methodology publication-title: Phys. Rev. B doi: 10.1103/PhysRevB.73.045112 – ident: ref_44 doi: 10.3390/ma16247528 – volume: 22 start-page: 18284 year: 2020 ident: ref_14 article-title: A first-principles study on the magnetoelectric coupling induced by Fe in a two-dimensional BaTiO3 (001) ultrathin film publication-title: Phys. Chem. Chem. Phys. doi: 10.1039/D0CP01968B – volume: 2 start-page: 61 year: 2010 ident: ref_47 article-title: Multiferroic magnetoelectric composite nanostructures publication-title: NPG Asia Mater. doi: 10.1038/asiamat.2010.32 – volume: 404 start-page: 109 year: 2010 ident: ref_43 article-title: First-principles study on dissolution and diffusion properties of hydrogen in molybdenum publication-title: J. Nucl. Mater. doi: 10.1016/j.jnucmat.2010.06.029 – volume: 14 start-page: 7039 year: 2022 ident: ref_2 article-title: Obtaining Greatly Improved Dielectric Constant in BaTiO3–Epoxy Composites with Low Ceramic Volume Fraction by Enhancing the Connectivity of Ceramic Phase publication-title: ACS Appl. Mater. Interfaces doi: 10.1021/acsami.1c25069 – volume: 94 start-page: 205121 year: 2016 ident: ref_15 article-title: Contradictory nature of Co doping in ferroelectric BaTiO3 publication-title: Phys. Rev. B doi: 10.1103/PhysRevB.94.205121 – volume: 191 start-page: 19 year: 2014 ident: ref_22 article-title: Magnetic and ferroelectric properties of Ni doped BaTiO3 publication-title: Solid State Commun. doi: 10.1016/j.ssc.2014.04.001 – volume: 17 start-page: 1087 year: 2018 ident: ref_9 article-title: Ferroelectrically tunable magnetic skyrmions in ultrathin oxide heterostructures publication-title: Nat. Mater. doi: 10.1038/s41563-018-0204-4 – volume: 54 start-page: 11169 year: 1996 ident: ref_25 article-title: Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set publication-title: Phys. Rev. B doi: 10.1103/PhysRevB.54.11169 – volume: 23 start-page: 1062 year: 2011 ident: ref_48 article-title: Recent Progress in Multiferroic Magnetoelectric Composites: From Bulk to Thin Films publication-title: Adv. Mater. doi: 10.1002/adma.201003636 – volume: 64 start-page: 1045 year: 1992 ident: ref_29 article-title: Iterative minimization techniques for ab initio total-energy calculations: Molecular dynamics and conjugate gradients publication-title: Rev. Mod. Phys. doi: 10.1103/RevModPhys.64.1045 – volume: 46 start-page: 27336 year: 2020 ident: ref_11 article-title: Correlation between structure, dielectric and multiferroic properties of lead free Ni modified BaTiO3 solid solution publication-title: Ceram. Int. doi: 10.1016/j.ceramint.2020.07.219 – volume: 92 start-page: 112501 year: 2008 ident: ref_16 article-title: Magnetic behavior and thickness dependence in Co-doped BaTiO3 thin films publication-title: Appl. Phys. Lett. doi: 10.1063/1.2898525 – volume: 120 start-page: 257 year: 2016 ident: ref_10 article-title: RETRACTED: A study approach on ferroelectric domains in BaTiO3 publication-title: Mater. Charact. doi: 10.1016/j.matchar.2016.09.015 – volume: 34 start-page: 232 year: 1998 ident: ref_45 article-title: Sol–gel BaTiO3 from a peptized solution publication-title: Mater. Lett. doi: 10.1016/S0167-577X(97)00161-4 – volume: 13 start-page: 5188 year: 1976 ident: ref_31 article-title: Special points for Brillouin-zone integrations publication-title: Phys. Rev. B doi: 10.1103/PhysRevB.13.5188 |
| SSID | ssj0000913853 |
| Score | 2.2660005 |
| Snippet | The magnetization mechanism of Co-doped BaTiO3 ultrathin films is a subject of debate, which results in difficulties with the design of new multiferroics based... |
| SourceID | doaj proquest crossref |
| SourceType | Open Website Aggregation Database Index Database |
| StartPage | 586 |
| SubjectTerms | Barium titanates Co substitution Direct current Electric fields ferromagnetic behavior under electric field First principles Magnetic domains Magnetic fields magnetoelectric coupling mechanism of nonmagnetic characteristics Multiferroic materials Phase transitions Room temperature Simulation Stoichiometry Thin films two-dimensional BaTiO3 Wave power |
| SummonAdditionalLinks | – databaseName: DOAJ (Directory of Open Access Journals) dbid: DOA link: http://utb.summon.serialssolutions.com/2.0.0/link/0/eLvHCXMwrV3NS8MwFA-ykx7ET5xOiaDH4tokTXt0H2UIfhw28FbSJtHB1g7dFK_-5b6XdqPgwYtQemgfbXkfeb-XvvxCyJXkudWAw70gxtkqbq0HruxOuQiljf3cNcg-hKMJv3sWz42tvrAnrKIHrhR3k4VIgSe5FZnmIfib4CY2AEJ0FIkosjj6Qs5rFFNuDI59Bomo6nRnUNffFKoooZiQXYHLphs5yFH1_xqJXXpJ9shujQvpbfU9-2TLFAdkp8EWeEi-kylANe9pPT3-TrEJ8IuWBR1-1B5ES0vv1UuBSxPpoJxD3U_hGH-W3gB5_CsODtpT4-kjo5MZctO-gkAync1BfmE0xZlZ2i8pri57o0O3TQ48LMFWtyMySYbj_sirt1Dwcibk0tOadyEimYwst5IxE0usKJQG3MVDy33I8JEvADXqLA-YMUwJP-vGGYSmDbhlx6RVlIU5ITSXRnOlQq5izXNfKBOAnQFxyNx0jTJtcr1WarqomDJSqDBQ-WlT-W3SQ41vZJDf2l0Aq6e11dO_rN4mnbW90jro3lOGXDoC6h94x-XmNoQL_gNRhSlXTibiLGQ8OP2P7zgj2wGgnKqVp0Nay7eVOQeUsswunEP-AMHh43U priority: 102 providerName: Directory of Open Access Journals |
| Title | First-Principles Study on Evolution of Magnetic Domain in Two-Dimensional BaTiO3 Ultrathin Film Doped with Co under Electric Field |
| URI | https://www.proquest.com/docview/3037455856 https://www.proquest.com/docview/3038436342 https://doaj.org/article/b6506074f5bd4604854e9e566d88588f |
| Volume | 14 |
| hasFullText | 1 |
| inHoldings | 1 |
| isFullTextHit | |
| isPrint | |
| link | http://utb.summon.serialssolutions.com/2.0.0/link/0/eLvHCXMwfV3da9swEBdr-rI9jH2yrF3QYHs0jS3Jkp_G0sYrg3VlJNA3I-ujC7RWlqQde91fvjtZyQKDgfGDfehBujv97nT6HSHvJDfeAg7PigqzVdz7DFQ5vowopa9yEwtkL8rzOf98Ja5Swm2dyiq3PjE6ahsM5shPGBKlCAC35Yfljwy7RuHpamqhcUAOwQUrNSCHk-nF5bddlgVZL2FD6iveGcT3J53uAgQVcizw-vTeXhQp-__xyHGbqZ-Qxwkf0o_9gj4lD1z3jDzaYw18Tn7XC4Bs2eU2Tb6mWAz4i4aOTu-TJtHg6Rd93eEVRXoWbiH-p_DMfobsDPn8ey4OOtGzxVdG5zfIUfsdBOrFzS3IL52lmKGlp4HiLbMVncZ2OTBYjSVvL8i8ns5Oz7PUSiEzTMhNZi0fg2UyqTz3kjFXSYwstAX8xUvPc9jpVS4APdrWFMw5pkXejqsWTNQX3LOXZNCFzr0i1EhnudYl15XlJhfaFbDegDykcWOn3ZC8305qs-wZMxqINHDym_3JH5IJzvhOBnmu44ewum6S2TRtiQSIknvRWl6CtxHcVQ4gqFVKKOWH5Hi7Xk0yvnXzV1WG5O3uN5gNnoXozoW7KKM4KxkvXv9_iCPysAAc0xfrHJPBZnXn3gAO2bQjcqDqT6OkcqMYzf8B7FDfaA |
| linkProvider | ProQuest |
| linkToHtml | http://utb.summon.serialssolutions.com/2.0.0/link/0/eLvHCXMwtV1Lb9QwEB6VcgAOiKe60IKR6DFqNrbj5IAQ7W7Y0gccdqXeghPbZaU2Xna3VL3yg_iNncljWQmJW6Uoh2Tkw_iz5_N4HgDvlSidQR4eRCl5q4RzAUK5fpUyVi7tl3WA7Gk8mogvZ_JsA_50uTAUVtntifVGbXxJPvI9ToVSJJLb-OPsZ0Bdo-h2tWuh0cDiyN5c45Ft8eFwgPO7G0XZcHwwCtquAkHJpVoGxogQQcpV4oRTnNtUEcnWBqmIiJ3oo9FL-hKJlCnKiFvLtewXYVogWl0kHMdx78F9wdGSU2Z69nnl06Eam2j-mvh6_B_uVbryeIRRoaRk7TXLVzcI-Gf_r41a9gQet2yUfWrg8xQ2bPUMHq3VKHwOv7MpEsTgW-eUXzAKPbxhvmLDXy1umXfsRJ9XlBDJBv5STyuGz_jaBwPqHtBU_mD7ejz9ytnkgiri_kCBbHpxifIzaxj5g9mBZ5TTNmfDujkPDpZRgN0LmNyJil_CZuUruwWsVNYIrWOhUyPKvtQ2QnQhz1GlDa22PdjtlJrPmvocOZ5rSPn5uvJ7sE8aX8lQVe36g5-f5-0izYuYyi0q4WRhRIx7mxQ2tUh4TZLIJHE92O7mK2-X-iL_C8wevFv9xkVKNy-6sv6qlkkEj7mIXv1_iLfwYDQ-Oc6PD0-PXsPDCBlUEya0DZvL-ZXdQQa0LN7UsGPw_a5xfgtXmhaS |
| linkToPdf | http://utb.summon.serialssolutions.com/2.0.0/link/0/eLvHCXMwtV1Lb9NAEB6VVEJwQDzVQAuLRI9WHO-u1z4gRJpYLYUQoUTqzay9uyVSa4ckpeqVn8Wv64wfIRISt0qWD_ZoD7Pf7nw7Ow-Ad0rkziAP94KYvFXCOQ-hXL1yGSoX9_MqQHYcHs_EpzN5tgN_2lwYCqts98RqozZlTj7yHqdCKRLJbdhzTVjEZJh8WPz0qIMU3bS27TRqiJzam2s8vq3enwxxrg-DIBlNj469psOAl3Op1p4xwkfAchU54RTnNlZEuLVBWiJCJ_poAKO-RFJlsjzg1nIt-5kfZ4hcFwjHcdx7sKvoVNSB3cFoPPm28fBQxU00hnW0Peex3yt0UeKBRvmSUre37GDVLuAfa1CZuOQxPGq4KftYg-kJ7NjiKTzcqlj4DH4nc6SL3qR10a8YBSLesLJgo18Nilnp2Bd9XlB6JBuWl3peMHym16U3pF4CdR0QNtDT-VfOZhdUH_cHCiTzi0uUX1jDyDvMjkpGGW5LNqpa9eBgCYXbPYfZnSj5BXSKsrB7wHJljdA6FDo2Iu9LbQPEGrIelVvfatuFw1ap6aKu1pHiKYeUn24rvwsD0vhGhmpsVx_K5XnaLNk0C6n4ohJOZkaEuNNJYWOL9NdEkYwi14X9dr7SZuGv0r8w7cLbzW9csnQPowtbXlUykeAhF8HL_w_xBu4jxtPPJ-PTV_AgQDpVxwztQ2e9vLIHSIfW2esGdwy-3zXUbwHunhwk |
| openUrl | ctx_ver=Z39.88-2004&ctx_enc=info%3Aofi%2Fenc%3AUTF-8&rfr_id=info%3Asid%2Fsummon.serialssolutions.com&rft_val_fmt=info%3Aofi%2Ffmt%3Akev%3Amtx%3Ajournal&rft.genre=article&rft.atitle=First-Principles+Study+on+Evolution+of+Magnetic+Domain+in+Two-Dimensional+BaTiO3+Ultrathin+Film+Doped+with+Co+under+Electric+Field&rft.jtitle=Nanomaterials+%28Basel%2C+Switzerland%29&rft.au=Gao%2C+Haigen&rft.au=Tang%2C+Yu&rft.au=Liao%2C+Qilong&rft.au=Zhao%2C+Xiangyu&rft.date=2024-04-01&rft.pub=MDPI+AG&rft.eissn=2079-4991&rft.volume=14&rft.issue=7&rft.spage=586&rft_id=info:doi/10.3390%2Fnano14070586&rft.externalDBID=HAS_PDF_LINK |
| thumbnail_l | http://covers-cdn.summon.serialssolutions.com/index.aspx?isbn=/lc.gif&issn=2079-4991&client=summon |
| thumbnail_m | http://covers-cdn.summon.serialssolutions.com/index.aspx?isbn=/mc.gif&issn=2079-4991&client=summon |
| thumbnail_s | http://covers-cdn.summon.serialssolutions.com/index.aspx?isbn=/sc.gif&issn=2079-4991&client=summon |