Article
Physics, Multidisciplinary
Saad Tariq, Ayash O. Alrashdi, Afaq Ahmed, A. A. Mubarak
Summary: This study presents a detailed investigation on the influence of Ni substitution on LaFeO3 using the Kohn-Sham scheme of density functional theory. The compounds studied showed good agreement with experimental results, but the mechanical and optical properties of the doped structures were reported for the first time. Structural stability was extensively checked through various criteria, and electronic and optical properties suggested highly conducting and reflecting phases of the compounds. Magnetic analyses showed a decrease in magnetic moment with an increase in Ni content, and mechanical analyses indicated an increase in strength of the Ni substituted LaFeO3. The results suggest potential applications in flexible electronic devices.
Article
Chemistry, Physical
Jungcheol Kim, Eunjung Ko, Jaeyeon Jo, Miyoung Kim, Hyobin Yoo, Young-Woo Son, Hyeonsik Cheong
Summary: Recent studies have found unexpected characteristics in moire superlattices formed by stacking two-dimensional crystals. In this study, the authors report whirlpool-shaped periodic lattice distortions in moire superlattices, which lead to anomalous optical responses. These findings are important for understanding the structure-property relationship of moire superlattices.
Article
Materials Science, Multidisciplinary
Victor Rosendal, Walber H. Brito, Milan Radovic, Alla Chikina, Mads Brandbyge, Nini Pryds, Dirch H. Petersen
Summary: This study maps the energy landscape of octahedral tilting in Strontium niobate using density functional theory calculations, and finds that compressive strain induces tilting around the out-of-plane axis, while tensile strain induces tilting around the in-plane axes. The competition between in-phase and out-of-phase tilting in SrNbO3 allows for tuning the thermoelectric and optical properties. The study also shows how the tilt angle and mode affect the Seebeck coefficient and the plasma frequency due to changes in the band structure.
PHYSICAL REVIEW MATERIALS
(2023)
Article
Chemistry, Multidisciplinary
Hsiang-Wei Tsai, Yen-Hsun Su
Summary: This study focused on enhancing the photocatalytic performance of catalysts for water-splitting reaction through surface plasmon resonance (SPR) effect and hetero-junction structure. Double perovskite LaFe(1-x)NixO(3) particles were synthesized and decorated with sea urchin-like Au nanoparticles (NPs). The hybrid structure showed improved photoelectrochemical hydrogen production efficiency, with the H-2 efficiency measured in ethanol significantly higher than in 1-butanol due to lower activation energies in the former solvent.
Article
Chemistry, Physical
Vivien L. Cherrette, Finn Babbe, Jason K. Cooper, Jin Z. Zhang
Summary: Exciton-phonon interactions are found to cause broadening of photoluminescence line width and slower electron-hole recombination in cubic CsPbBr3 perovskite quantum dots (PQDs) due to structural distortions at room temperature. At low temperature, phonon-assisted recombination is reduced, resulting in minimized line width broadening.
JOURNAL OF PHYSICAL CHEMISTRY LETTERS
(2023)
Article
Chemistry, Multidisciplinary
Hyeon Han, Hua Zhou, Charles Guillemard, Manuel Valvidares, Arpit Sharma, Yan Li, Ankit K. Sharma, Ilya Kostanovskiy, Arthur Ernst, Stuart S. P. Parkin
Summary: This study uses the hydrogen spillover method to tailor the properties of SrRuO3 thin films by incorporating hydrogen. It is found that the magnetization and Curie temperature of the films are significantly reduced, and the structure evolves from an orthorhombic to a tetragonal phase with increasing hydrogen content. In situ crystal truncation rod measurements show that the structural phase transition is related to tilting of the RuO6 octahedral units. Density functional theory analysis demonstrates that the significant changes in magnetization result from shifts in the Fermi level. These findings provide new insights into the physical properties of SrRuO3 through the modulation of its lattice symmetry and emergent physical phenomena using the hydrogen spillover technique.
ADVANCED MATERIALS
(2023)
Article
Chemistry, Physical
Mengyu Ge, Robert W. Molt, Huw T. Jenkins, G. Michael Blackburn, Yi Jin, Alfred A. Antson
Summary: The octahedral TSA complex MgF3(H2O)(-) observed in a 1.5 A resolution crystal structure of Zika virus NS3 helicase, along with independent validation by F-19 NMR, highlights the significance of this complex in studies of biological motors.
Article
Chemistry, Physical
Frederick P. Marlton, Alex J. Brown, Matthew Sale, Andrey Maljuk, Bernd Buechner, William Lewis, Ian Luck, Michelle L. Wood, Richard A. Mole, Chris D. Ling
Summary: The mixed ionic-electronic conductor 6HBa4Ta2O9 undergoes an unconventional lattice distortion upon cooling in the presence of water, which is linked to the onset of hydration. The large Ba2+ cations present in its hexagonal perovskite-type structure cause expansion of adjacent vacant octahedral sites, allowing for incorporation of hydration species. This destabilizes the structure, leading to a symmetry-lowering distortion that cannot be explained conventionally.
CHEMISTRY OF MATERIALS
(2023)
Article
Engineering, Environmental
Lianke Zhang, Lu Fan, Jian Fan, Yumei Li, Peng Sun, Jianhong Han, Zhanchun Fan
Summary: In this study, a novel catalyst was prepared to degrade quinoline effectively. By coupling the catalyst with PDS or H2O2 under visible light, the degradation of quinoline was achieved. The Vis/PDS/LaFe1-xCuxO3 system showed advantages such as shorter degradation time, higher efficiency, and stronger adaptability. It is an environmentally friendly method for treating quinoline-containing industrial wastewater.
JOURNAL OF ENVIRONMENTAL CHEMICAL ENGINEERING
(2022)
Article
Materials Science, Ceramics
P. Amalthi, J. Judith Vijaya, L. John Kennedy, A. Mustafa, M. Bououdina, K. P. Shinde, D. H. Kim
Summary: Through the study of multicomponent perovskite nanomaterials, we found that the substitution of ions can affect the structure, magnetic and magnetocaloric properties of the materials. X-ray diffraction analysis confirmed the presence of a secondary cubic phase Nd2O3. The magnetocaloric effect was assessed through the magnetic-entropy change.
CERAMICS INTERNATIONAL
(2022)
Article
Materials Science, Ceramics
Zhao Fei Tong, Chuang Tian, Qingrong Yao, Jinxiang Guo, Qihua Liang, Jianqiu Deng, Fangyu Gan, Jiang Wang, Huaiying Zhou, Guanghui Rao
Summary: In this study, a high-purity NdFe1-xNixO3 material was prepared by a sol method, and it was found that by adding a certain amount of nickel, the dielectric and magnetic properties of the material can be adjusted to a balance point, showing excellent microwave absorption performance.
CERAMICS INTERNATIONAL
(2022)
Article
Materials Science, Multidisciplinary
G. D. Dwivedi, Tsung-Wen Yen, S. M. Kumawat, C. W. Wang, D. Chandrasekhar Kakarla, A. Tiwari, H. D. Yang, S. M. Huang, C. M. Chung, S. J. Sun, H. Chou
Summary: Magnetic exchange interactions in Mn3O4 spinel systems are complicated due to magnetic frustration and correlated Jahn-Teller distortion. The tetrahedral-octahedral exchange interaction is the most dominant interaction, while doping of Cr3+ ions reduces the Jahn-Teller distortion and magnetic moment, affecting magnetic anisotropy, exchange interaction, and frustration.
JOURNAL OF MATERIALS CHEMISTRY C
(2023)
Article
Materials Science, Multidisciplinary
F. Scaravaggi, S. Sauerland, L. Wang, R. Kappenberger, P. Lepucki, A. P. Dioguardi, X. Hong, F. Caglieris, C. Wuttke, C. Hess, H-J Grafe, S. Aswartham, S. Wurmehl, R. Klingeler, A. U. B. Wolter, B. Buechner
Summary: Through magnetic susceptibility studies and high-resolution capacitance dilatometry experiments, we identified the phase diagram properties of Co-doped LaFeAsO. As the Co content increases, the antiferromagnetic and nematic phases gradually weaken, with bulk superconductivity appearing around 6% Co content. However, superconductivity decreases as the Co content goes higher.
Article
Electrochemistry
Jiayun Li, Wangting Luo, Xiaoqian Wang, Chao Yu, Yujie Zhang, Fanbin Meng
Summary: The effect of Ni doping on the structural and electrochemical properties of LaMn1-xNixO3 nanoparticles synthesized through hydrothermal synthesis and calcinations were studied. The LaMn0.5Ni0.5O3 sample exhibited high capacitance and good cycling stability. Theoretical calculations provided further insight into the electrochemical performance.
Article
Physics, Multidisciplinary
Refka Andoulsi-Fezei, Karima Horchani-Naifer, Mokhtar Ferid
Summary: The paper investigates the impedance and dielectric properties of lead free perovskites LaFe1-xZnxO3-d, showing that substitution improves dielectric properties and increases ε' values.
EUROPEAN PHYSICAL JOURNAL PLUS
(2021)
Article
Physics, Applied
Seung Hwae Heo, Seongheon Baek, Tae Joo Shin, Jae Sung Son
Summary: In this study, textured SnSe2 thin films were fabricated using a solution-processed method, which exhibited strong crystallographic orientation and high electron concentrations. The microstructure of the thin films determined their electronic transport properties, and the optimal structure showed an enhanced thermoelectric power factor. These findings provide a way to enhance the thermoelectric and electronic properties of highly anisotropic materials.
APPLIED PHYSICS LETTERS
(2022)
Article
Chemistry, Physical
Syeda Javeria Kazmi, M. Nadeem, Muhammad Asif Warsi, Sadia Manzoor, Babar Shabbir, Shahzad Hussain
Summary: Lightweight and flexible electromagnetic interference (EMI) shields and electromagnetic wave (EMW) absorbers with low filler and improved impedance matching are the focus of global research. In this study, CoFe2O4@CNTs hybrids were synthesized in situ by solvothermal method and then flexible PVDF/CoFe2O4@CNTs composites were prepared by solution casting. The composites exhibited good impedance matching and shielding effectiveness of 12.68 dB at a thickness of 1.88 mm when 7 wt% of CFO@CNTs hybrids were incorporated in PVDF. The composites also showed excellent absorption properties with a minimum reflection loss (RLmin) of -26.09 dB at 11.26 GHz when backed with a metallic conductor.
JOURNAL OF ALLOYS AND COMPOUNDS
(2022)
Article
Physics, Applied
Lok-Ping Ho, Muhammad Younas, Jon Borgersen, Rao Tahir Ali Khan, Seyed Javad Rezvani, Simone Pollastri, Muhammad Javed Akhtar, Muhammad Nadeem, Dong Huang, Ying-Li Shi, Andrej Kuznetsov, Francis Chi-Chung Ling
Summary: Discovering multifunctional materials is crucial for advancing science and technology. This study reports on an optical phenomenon in the metal-ZnO:Cu junction, where the light emission intensity from photoluminescence can be reversibly tuned by applying electric bias. X-ray absorption measurements revealed changes in the oxidation state of Cu+/Cu2+ and modulation of the Zn-O bond fingerprints, providing insights into the modulation phenomena.
JOURNAL OF PHYSICS D-APPLIED PHYSICS
(2022)
Article
Multidisciplinary Sciences
Seohee Yun, Huijeong Hwang, Gilchan Hwang, Yeongkyoo Kim, Douglas Blom, Thomas Vogt, Jeffrey E. Post, Tae-Yeol Jeon, Tae Joo Shin, Dong-Zhou Zhang, Hiroyuki Kagi, Yongjae Lee
Summary: This study reveals the presence of super-hydrated birnessite, known as buserite, in manganese nodules found on the ocean floor. Buserite remains stable up to depths of 70 km before transforming into manganite. The subsequent transformations to hausmannite and pyrochroite occur at depths of approximately 100 km and 120 km, respectively, accompanied by a reduction in the oxidation state of manganese. These findings provide insights into the geochemical cycle of manganese minerals in subduction and other aqueous terrestrial environments, and have implications for water storage and cycling.
NATURE COMMUNICATIONS
(2022)
Article
Materials Science, Multidisciplinary
Amara Nasir, Asif Raza, Mehwish Tahir, Tariq Yasin, Muhammad Nadeem, Bashir Ahmad
Summary: This article introduces a novel conducting nanohybrid material prepared by graft polymerization on gamma-irradiated graphene oxide (GO). The results show that the optimal nanohybrid exhibits excellent electrical conductivity and electromagnetic interference shielding effectiveness, demonstrating better performance than the original material.
MATERIALS RESEARCH BULLETIN
(2023)
Article
Physics, Condensed Matter
T. Rafique, M. Atif, M. Nadeem, T. Meydan, J. Cuenca, W. Khalid, Z. Ali
Summary: Chromium-doped Ni0.3Co0.2Zn0.5Fe2-xCrxO4 (0.0 ≤ x ≤ 0.1) nanoferrites were synthesized via the sol-gel technique, and the influence of cation distribution on their physical properties was investigated.
PHYSICA B-CONDENSED MATTER
(2023)
Article
Nanoscience & Nanotechnology
Junghyun Lee, Gergely Tarsoly, Taejoo Shin, Kyoseung Sim, Seungmoon Pyo
Summary: In this study, solution-processed micro-sized single-crystalline organic wire of n-type PTCDI-C-5 was fabricated and characterized. The wire exhibited high n-type performance, air stability, and light-sensitive characteristics. The highly crystalline organic semiconductor can be used in high-performance electronic circuits and sensors.
ACS APPLIED MATERIALS & INTERFACES
(2023)
Article
Materials Science, Multidisciplinary
T. Rafique, M. Atif, J. Cuenca, S. Mandal, T. Meydan, Z. Ali, W. Khalid, M. Nadeem
Summary: Hollow Ni1-xZnxFe2O4 spheres were synthesized using the solvothermal process and their crystal structure was determined through X-ray diffraction analysis. The vibrational properties of the material were investigated using Raman spectroscopy. Scanning electron microscopy and transmission electron microscopy were used to confirm the morphologies and distribution of elements. The prepared hollow spheres exhibited improved magnetic properties, especially for NiFe2O4 and ZnFe2O4 samples. The complex permittivity and permeability were measured at microwave frequencies and the Ni0.5Zn0.5Fe2O4 sample showed potential for enhanced microwave absorption.
JOURNAL OF MAGNETISM AND MAGNETIC MATERIALS
(2023)
Article
Engineering, Electrical & Electronic
Muhammad Rafi, G. Uzma, Muhammad Arfan, Rashad Rashid, Zahoor Ahmad, Muhammad Nadeem
Summary: Low-temperature ZnO was synthesized using a single-step composite hydroxide-mediated (CHM) technique. The prepared sample was characterized and confirmed to have an average crystallite size of around 15 nm by X-ray diffraction (XRD). Field emission scanning electron microscopy (FE-SEM) results showed uniform spherical shape and narrow size distribution. The dielectric behavior revealed high dielectric constant (epsilon') and low dielectric loss, making ZnO a suitable material for practical applications.
JOURNAL OF MATERIALS SCIENCE-MATERIALS IN ELECTRONICS
(2023)
Article
Multidisciplinary Sciences
Jaewang Park, Jongbeom Kim, Hyun-Sung Yun, Min Jae Paik, Eunseo Noh, Hyun Jung Mun, Min Gyu Kim, Tae Joo Shin, Sang Il Seok
Summary: Controlling the crystallinity and surface morphology of perovskite layers is crucial for achieving high-efficiency perovskite solar cells. By adding alkylammonium chlorides (RACl) to a-formamidinium lead iodide (FAPbI(3)), the crystallization process and surface morphology of the perovskite thin films can be controlled. The resulting perovskite thin layers facilitate the fabrication of perovskite solar cells with a high power-conversion efficiency of 26.08%.
Article
Multidisciplinary Sciences
Jong-Hoon Kim, Tian-Yi Dai, Mihyun Yang, Jeong-Min Seo, Jae Seong Lee, Do Hyung Kweon, Xing-You Lang, Kyuwook Ihm, Tae Joo Shin, Gao-Feng Han, Qing Jiang, Jong-Beom Baek
Summary: In this study, the authors demonstrate that metallic potassium can be used as a catalyst for ammonia synthesis, despite its volatility at high temperature. Metallic potassium is not used in industrial ammonia synthesis due to its tendency to separate from the catalyst in the harsh synthesis conditions. However, the authors find that using metallic potassium at lower temperatures can significantly improve the efficiency of ammonia synthesis. In their experiments, they achieved a much higher concentration of ammonia compared to the traditional Haber-Bosch process and their previous work.
NATURE COMMUNICATIONS
(2023)
Article
Chemistry, Inorganic & Nuclear
Sungjun Yang, Jong Hoon Lee, Tae Joo Shin, Sangmoon Park
Summary: Oxygen vacancies in the phosphors were observed by investigating bond-length fluctuations, oxygen 1s profile, and Ge2+/Ge4+ oxidation state using synchrotron X-ray diffraction refinement, X-ray photoelectron spectroscopy, and Ge K-edge X-ray absorption near-edge structure spectra, respectively. The Ba8.8Ce0.1Na0.1Y2Ge6O24 orthogermanate phosphor, prepared by LiCl flux assistance under a reducing atmosphere, exhibited a mysterious green-yellow emission at 298 K. This emission results from the active 6-coordinated antiprism oxygen geometry around the Ce3+ ions in the phosphors.
INORGANIC CHEMISTRY
(2023)
Article
Chemistry, Multidisciplinary
U. Younas, M. Atif, A. Anjum, M. Nadeem, T. Ali, R. Shaheen, W. Khalid, Z. Ali
Summary: Lanthanum (La3+) doped Ba1-xLaxTiO3 (x = 0.0, 0.0025, 0.005, 0.0075) ceramics were synthesized using the composite-hydroxide-mediated method. The XRD patterns confirmed the formation of a perovskite crystal structure that changes with La3+ doping content. SEM analysis showed a dense and homogeneous microstructure with smaller grain size on La3+ doping. Dielectric measurements revealed improved permittivity, decreased transition temperature, and increased diffusivity with increasing La3+ doping. Impedance analysis indicated semiconducting behavior and a charge compensation mechanism. Ferroelectric hysteresis loops demonstrated ferroelectricity and improved energy storage efficiency due to reduced grain size on La3+ doping. The sample with x = 0.005 exhibited the highest dielectric permittivity, lowest tangent loss, and highest energy storage efficiency, making it suitable for energy storage applications.
Article
Chemistry, Multidisciplinary
Feng Li, Canglang Yao, Jong-Pil Jeon, Gao-Feng Han, Tae Joo Shin, Ali Han, Zhengping Fu, Yalin Lu, Jong-Beom Baek
Summary: This study presents the development of a hollow nitrogenated carbon sphere dispersed rhodium single atom catalyst (Rh1HNC) as an efficient bifunctional catalyst. The Rh1HNC was obtained by anchoring Rh single atoms in the HNC matrix, forming an Rh-N3C1 structure. The strong metal atom-support interaction (SMASI) between Rh and C atoms allows for robust electrochemical performance in acidic media for both the hydrogen evolution and oxygen reduction reactions. This work provides a strategy for the design and synthesis of efficient and stable bifunctional catalysts.
Article
Chemistry, Multidisciplinary
Atta Ur Rehman, M. Atif, M. Younas, T. Rafique, H. Wahab, A. Ul-Hamid, N. Iqbal, Z. Ali, W. Khalid, M. Nadeem
Summary: Magnetite (Fe3O4) nanoparticles were successfully prepared and characterized. The sample exhibited a single-phase cubic spinel structure and showed a semiconductor-metal-semiconductor like transition within a certain temperature range. It had a colossal dielectric permittivity and moderate conductivity, making it a potential candidate for electromagnetic absorbing materials.