Single-molecule junctions exploit the internal structure of molecular orbitals to construct a new class of functional quantum devices. The demonstration of negative differential resistance (NDR) in single-molecule junctions is direct evidence of quantum mechanical tunneling through a molecular orbital. Here, a pronounced NDR effect is reported with a peak-to-valley ratio of 30.1 on a single-molecule junction of π-conjugated quinoidal-fused oligosilole derivatives, Si2 × 2, embedded between the unique electroless gold-plated heteroepitaxial spherical Au/Pt nanogap electrodes. This NDR feature persists in a consecutive endurance test of 180 current traces. the thermally stable NDR effects in the Si2 × 2 single-molecule junctions between 9 and 300 K are demonstrated. The density functional theory calculations under electric fields indicate that the NDR effect can be ascribed to the bias-dependent resonant tunneling transport via the polarized HOMO, which has asymmetrically changed electrode coupling with increased bias voltages. The results confirm a promising electrical platform for constructing functional quantum devices at the single-molecule level.
{"title":"Negative Differential Resistance in Single-Molecule Junctions Based on Heteroepitaxial Spherical Au/Pt Nanogap Electrodes","authors":"Dongbao Yin, Miku Furushima, Eiji Tsuchihata, Seiichiro Izawa, Tomoya Ono, Ryo Shintani, Yutaka Majima","doi":"10.1002/aelm.202400390","DOIUrl":"https://doi.org/10.1002/aelm.202400390","url":null,"abstract":"Single-molecule junctions exploit the internal structure of molecular orbitals to construct a new class of functional quantum devices. The demonstration of negative differential resistance (NDR) in single-molecule junctions is direct evidence of quantum mechanical tunneling through a molecular orbital. Here, a pronounced NDR effect is reported with a peak-to-valley ratio of 30.1 on a single-molecule junction of π-conjugated quinoidal-fused oligosilole derivatives, Si2 × 2, embedded between the unique electroless gold-plated heteroepitaxial spherical Au/Pt nanogap electrodes. This NDR feature persists in a consecutive endurance test of 180 current traces. the thermally stable NDR effects in the Si2 × 2 single-molecule junctions between 9 and 300 K are demonstrated. The density functional theory calculations under electric fields indicate that the NDR effect can be ascribed to the bias-dependent resonant tunneling transport via the polarized HOMO, which has asymmetrically changed electrode coupling with increased bias voltages. The results confirm a promising electrical platform for constructing functional quantum devices at the single-molecule level.","PeriodicalId":110,"journal":{"name":"Advanced Electronic Materials","volume":null,"pages":null},"PeriodicalIF":6.2,"publicationDate":"2024-06-16","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"141333918","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":2,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Amalie P. Laursen, Jens P. Frandsen, Priyank Shyam, Mathias I. Mørch, Frederik H. Gjørup, Harikrishnan Vijayan, Mads R. V. Jørgensen, Mogens Christensen
The synthesis of a strontium hexaferrite magnet is studied using in situ synchrotron powder X-ray diffraction (PXRD) with a 16-ms time resolution. The precursor material is cold compacted shape-controlled goethite and strontium carbonate. The time evolution of the phases is modeled with sequential Rietveld refinements revealing that strontium hexaferrite forms within seconds at ≈1173 K. Texture analysis is performed on selected PXRD frames throughout the experiment, and the preferred orientation introduced by cold-pressing goethite prevails through the iron oxide phase transitions (goethite → hematite → strontium hexaferrite). Electron backscatter diffraction (EBSD) data on the final pellet confirms the preferred orientation observed with PXRD. The resulting magnet has respectable magnetic properties, considering the simplicity of the preparation method, with an energy product (BHmax) of 18.6(8) kJ m−3.
{"title":"Aligned Permanent Magnet Made in Seconds–An In Situ Diffraction Study","authors":"Amalie P. Laursen, Jens P. Frandsen, Priyank Shyam, Mathias I. Mørch, Frederik H. Gjørup, Harikrishnan Vijayan, Mads R. V. Jørgensen, Mogens Christensen","doi":"10.1002/aelm.202400077","DOIUrl":"https://doi.org/10.1002/aelm.202400077","url":null,"abstract":"The synthesis of a strontium hexaferrite magnet is studied using in situ synchrotron powder X-ray diffraction (PXRD) with a 16-ms time resolution. The precursor material is cold compacted shape-controlled goethite and strontium carbonate. The time evolution of the phases is modeled with sequential Rietveld refinements revealing that strontium hexaferrite forms within seconds at ≈1173 K. Texture analysis is performed on selected PXRD frames throughout the experiment, and the preferred orientation introduced by cold-pressing goethite prevails through the iron oxide phase transitions (goethite → hematite → strontium hexaferrite). Electron backscatter diffraction (EBSD) data on the final pellet confirms the preferred orientation observed with PXRD. The resulting magnet has respectable magnetic properties, considering the simplicity of the preparation method, with an energy product (<i>BH</i><sub>max</sub>) of 18.6(8) kJ m<sup>−3</sup>.","PeriodicalId":110,"journal":{"name":"Advanced Electronic Materials","volume":null,"pages":null},"PeriodicalIF":6.2,"publicationDate":"2024-06-13","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"141329573","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":2,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Chen-Chen Er, Cheng-May Fung, Wei-Kean Chong, Yong Jieh Lee, Lling-Lling Tan, Yee Sin Ang, Nikhil V. Medhekar, Siang-Piao Chai
Elemental phosphorus in its various allotropes has received tremendous research attention recently due to its intriguing electronic and structural properties. Notably, the application of nanostructured materials to overcome the inherent flaws in bulk materials is promising. However, many challenges need to be addressed before its widespread implementation. Thus, a specific tenet to design novel and robust nanomaterials is a decisive factor in the desired outcome, and the most daunting task before realizing this is solving the Schrödinger equation. First principle density functional theory (DFT) calculations have emerged as an insightful and accurate design tool to investigate the structural, electronic, and possible synthesis scenarios of yet undiscovered materials at atomic levels. In this review, the basic principles and the importance of DFT are discussed, followed by a summary of recent advances in the first principle study of elemental phosphorus-based nanomaterials. Elemental phosphorus-based nanomaterials and their allotropes have attracted growing interest in the renewable energy community due to their modulable product selectivity. However, the understanding of the physical phenomena of allotropic modification is still lacking. Therefore, the aim is to motivate experimental researchers to conduct DFT studies and experiments to comprehend relevant engineered nanomaterials better. Finally, the challenges and potential future research directions for further theoretical and computational development of phosphorus-based nanomaterials are outlined.
{"title":"Computational Design of 2D Phosphorus Nanostructures for Renewable Energy Applications: A Review","authors":"Chen-Chen Er, Cheng-May Fung, Wei-Kean Chong, Yong Jieh Lee, Lling-Lling Tan, Yee Sin Ang, Nikhil V. Medhekar, Siang-Piao Chai","doi":"10.1002/aelm.202300869","DOIUrl":"https://doi.org/10.1002/aelm.202300869","url":null,"abstract":"Elemental phosphorus in its various allotropes has received tremendous research attention recently due to its intriguing electronic and structural properties. Notably, the application of nanostructured materials to overcome the inherent flaws in bulk materials is promising. However, many challenges need to be addressed before its widespread implementation. Thus, a specific tenet to design novel and robust nanomaterials is a decisive factor in the desired outcome, and the most daunting task before realizing this is solving the Schrödinger equation. First principle density functional theory (DFT) calculations have emerged as an insightful and accurate design tool to investigate the structural, electronic, and possible synthesis scenarios of yet undiscovered materials at atomic levels. In this review, the basic principles and the importance of DFT are discussed, followed by a summary of recent advances in the first principle study of elemental phosphorus-based nanomaterials. Elemental phosphorus-based nanomaterials and their allotropes have attracted growing interest in the renewable energy community due to their modulable product selectivity. However, the understanding of the physical phenomena of allotropic modification is still lacking. Therefore, the aim is to motivate experimental researchers to conduct DFT studies and experiments to comprehend relevant engineered nanomaterials better. Finally, the challenges and potential future research directions for further theoretical and computational development of phosphorus-based nanomaterials are outlined.","PeriodicalId":110,"journal":{"name":"Advanced Electronic Materials","volume":null,"pages":null},"PeriodicalIF":6.2,"publicationDate":"2024-06-12","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"141315815","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":2,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Musa Hussain, Hijab Zahra, Syed Muzahir Abbas, Yong Zhu
Dielectrics are non-conducting substances that are primarily utilized to hold electric charges. These materials are widely employed in the field of chemical mechanical, civil and structural engineering, because of their inherent insulating properties. Besides these domains, dielectric materials are also used in electrical and electronic applications. Dielectric materials have shown an ever-increasing potential in recent years in the fabrication of antennas, sensors, and optical devices that are extensively utilized for on-body, environmental, robotics, and biomedical applications. With inherent electrostatic shielding, insulation, and dielectric relaxations, these materials are used in intelligent electronic devices used for biomedical applications, smart devices, vehicles, and future IoT applications. Numerous applications necessitate multiple kinds of dielectric, classified based on their polarization, flexibility, thickness, dielectric constant, and specific application. In this extensive research review, the characteristics and various aspects of dielectric materials are discussed, followed by a thorough and detailed review of flexible dielectrics and their usage in flexible electronics. Additionally, the practicality and applications of these materials which come from a variety of publications in the literature are also discussed. Moreover, in-depth study of dieletrics in sensors and RF applications are performed.
{"title":"Flexible Dielectric Materials: Potential and Applications in Antennas and RF Sensors","authors":"Musa Hussain, Hijab Zahra, Syed Muzahir Abbas, Yong Zhu","doi":"10.1002/aelm.202400240","DOIUrl":"https://doi.org/10.1002/aelm.202400240","url":null,"abstract":"Dielectrics are non-conducting substances that are primarily utilized to hold electric charges. These materials are widely employed in the field of chemical mechanical, civil and structural engineering, because of their inherent insulating properties. Besides these domains, dielectric materials are also used in electrical and electronic applications. Dielectric materials have shown an ever-increasing potential in recent years in the fabrication of antennas, sensors, and optical devices that are extensively utilized for on-body, environmental, robotics, and biomedical applications. With inherent electrostatic shielding, insulation, and dielectric relaxations, these materials are used in intelligent electronic devices used for biomedical applications, smart devices, vehicles, and future IoT applications. Numerous applications necessitate multiple kinds of dielectric, classified based on their polarization, flexibility, thickness, dielectric constant, and specific application. In this extensive research review, the characteristics and various aspects of dielectric materials are discussed, followed by a thorough and detailed review of flexible dielectrics and their usage in flexible electronics. Additionally, the practicality and applications of these materials which come from a variety of publications in the literature are also discussed. Moreover, in-depth study of dieletrics in sensors and RF applications are performed.","PeriodicalId":110,"journal":{"name":"Advanced Electronic Materials","volume":null,"pages":null},"PeriodicalIF":6.2,"publicationDate":"2024-06-12","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"141309259","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":2,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Lu Wang and co-workers have fabricated a bioartificial synapse composited with egg albumen and carbon nanotubes (see article number 2300631). The electrical characteristics of the contact interface between carbon nanotubes doped with Fe substitution and Al electrode are analyzed by first principles, and the adsorption, charge distribution, and band structure between them are studied.