Review
Physics, Multidisciplinary
Chanchal Rani, Manushree Tanwar, Tanushree Ghosh, Suchita Kandpal, Shailendra K. Saxena, Rajesh Kumar
Summary: Raman spectroscopy, discovered in 1928, has become an extremely important analytical tool and has shown capabilities to obtain information about non-traditional physical processes in materials. Temperature dependent Raman spectra have revealed both anharmonic effects and nonlinear trends, which can be influenced by factors such as band structure, doping concentration, and film thickness.
PHYSICS REPORTS-REVIEW SECTION OF PHYSICS LETTERS
(2023)
Article
Chemistry, Multidisciplinary
Shuang Zhou, Zhong Wang, Chenyu Dong, Jie Bian, Weihua Zhang
Summary: This study investigated the wavelength-dependent laser-induced dynamic annealing of single plasmonic nano-antennas using in situ white light spectroscopy. The experiment revealed unexpected back-and-forth motions of rapidly melted single nano-antennas under excitation with a 532 nm laser, while gradual opening of nanogaps was observed with a 405 nm laser. Theoretical analyses suggested that the complex dynamics were caused by multiphysical processes at the nanoscale induced by the laser.
Article
Chemistry, Physical
Chanchal Rani, Manushree Tanwar, Suchita Kandpal, Tanushree Ghosh, Love Bansal, Rajesh Kumar
Summary: A nonlinear Fano interaction, observed through a temperature-dependent phonon decay process in Raman spectroscopy, has been investigated. The study reveals that in heavily doped systems, there is an interferon-mediated decay route for cold phonons at low temperatures, while anharmonic phonon decay remains the dominant process at higher temperatures.
JOURNAL OF PHYSICAL CHEMISTRY LETTERS
(2022)
Article
Chemistry, Physical
Jie Zheng, Cheng Zhang, Hong Li, Xianchao Liu, Yijia Huang, Jianqi Zhu, Zhilin Yang, Ling Li
Summary: In this study, highly uniform Si3N4 all-dielectric metasurfaces as sensing platforms were successfully fabricated using nanosphere self-assembly and plasma enhanced chemical vapor deposition techniques. Experimental and simulated results showed that the proposed Si3N4 all-dielectric metasurfaces exhibited multiple optical resonant modes in the ultraviolet and visible wavelength and showed distinct field confinement in the gaps of nanoparticles. The hotspots were successfully adjusted to the surface of Si3N4 nanoparticles. Si3N4 all-dielectric metasurfaces showed characteristic wavelength shifts with refractive index variation and achieved a sensitivity of 707 nm per RIU for trace detection as sensing substrates. Proposed Si3N4 all-dielectric metasurfaces hold promise as high-sensitive sensing substrates in the ultraviolet and visible wavelength with the ease of high-throughput fabrication.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS
(2023)
Article
Chemistry, Physical
Jiayi Li, Rui Li, Ying Xu, Xiaojun Xue, Xiaoming Chen, Hsiang-Chen Chui
Summary: This study proposes a simple and easily fabricated nanostructured template for surface-enhanced Raman spectroscopy (SERS) and analyzes the wavelength-dependent factors. The impact of different excitation wavelengths on SERS signals is investigated through experiments and simulations. The findings are helpful in understanding SERS signals when the excitation laser wavelength is located outside the resonance region of molecules and provide a new approach for designing and fabricating SERS templates with nanopillar arrays for different excitation wavelengths.
Article
Nanoscience & Nanotechnology
Ben Huang, Guodong Li, Bo Duan, Pengcheng Zhai, William A. Goddard
Summary: Molecular dynamics simulations were used to study the temperature-dependent anharmonic effects of Van der Waals sacrificial bonds in Bi2Te3 crystals during shearing. The synergy between sacrificial bonds and defects is suppressed with increasing temperature, resulting in reduced crystal deformability. Temperature-induced changes in nanocrystal deformation modes were identified through growth trend differences in deformation heterogeneity parameters.
SCRIPTA MATERIALIA
(2021)
Article
Multidisciplinary Sciences
Chisom Okeke, Isaac Juma, Antonio Cobarrubia, Nicholas Schottle, Hisham Maddah, Mansour Mortazavi, Sanjay K. Behura
Summary: The optothermal properties of physically exfoliated WS2 van der Waals crystal were studied using temperature-dependent Raman spectroscopy and machine learning strategies. This fundamental investigation will unveil the temperature dependence of WS2 and allows for the study of thermal conductivity, hot carrier diffusion coefficient, and thermal expansion coefficient.
Article
Materials Science, Multidisciplinary
J. Bonca, S. A. Trugman
Summary: This study explores the ground state and thermodynamic properties of a polaron coupled to quantum dispersive optical phonons in one spatial dimension. The finite-temperature Lanczos method is used to calculate the electron removal spectral function, and it is shown that photoemission spectroscopy can be used to measure the phonon dispersion relation in a dilute system of polarons.
Article
Optics
Shengde Liu, Peng Ju, Liupeng Lv, Ping Tang, Huiyang Wang, Liyun Zhong, Xiaoxu Lu
Summary: In this study, an optical nanoantenna is proposed by adding a gold nanoring to a conventional Fano-type resonance antenna. The gold nanoring facilitates enhancements in near-field intensity, directional radiation, and multi-wavelength tunability of the Fano resonance antenna. These improvements are demonstrated through numerical simulations and practical devices, showing potential for a wide range of applications in various fields.
Article
Chemistry, Multidisciplinary
Oleg S. Kudryavtsev, Rustem H. Bagramov, Arkady M. Satanin, Andrey A. Shiryaev, Oleg I. Lebedev, Alexey M. Romshin, Dmitrii G. Pasternak, Alexander Nikolaev, Vladimir P. Filonenko, Igor I. Vlasov
Summary: Diamonds, when hydrogenated, exhibit negative electron affinity, high p-type surface electrical conductivity, and a transparency peak in the infrared absorption spectrum. This discovery opens up new possibilities for exploring the physics of electron-phonon coupling in undoped semiconductors and the application of hydrogenated nanodiamonds as a new optical material with induced transparency in the infrared range.
Article
Nanoscience & Nanotechnology
Cheng Zong, Ji-Xin Cheng
Summary: Plasmon-enhanced stimulated Raman scattering (PESRS) microscopy has been developed to achieve single-molecule detection limit. The dispersive-like vibrational line shapes observed in PESRS can be explained by the interference between the local enhanced electromagnetic field induced by the plasmonic nanostructure and the molecular dipole-induced field. The PESRL and PESRG signals exhibit similar signal magnitudes but show reversed dispersive profiles under the same laser wavelength.
Article
Materials Science, Multidisciplinary
J. Bonca, S. A. Trugman
Summary: We studied the static and dynamic properties of an electron coupled to dispersive quantum optical phonons in the Holstein model on a one-dimensional lattice, finding that even small phonon dispersion significantly affects the low-energy optical response. With increasing dispersion, multiphonon excitation states become the lowest excited states of the system and determine the low-frequency response of the optical conductivity.
Article
Chemistry, Multidisciplinary
Xingda An, Joshua C. Kays, Ian Lightcap, Tianhong Ouyang, Allison M. Dennis, Bjorn M. Reinhard
Summary: The study integrates gold nanorods and chalcopyrite nanocrystals into water-stable nanocomposites for robust and bifunctional photocatalysis of oxygen and hydrogen evolution reactions. Excitation of gold nanorods or chalcopyrite nanocrystals correlates with increased hydrogen or oxygen evolution, with the direction of light-driven electron transfer depending on the wavelength.
Article
Materials Science, Multidisciplinary
C. Trallero-Giner, E. Menendez-Proupin, E. Suarez Morell, R. Perez-Alvarez, Dario G. Santiago-Perez
Summary: The study focuses on the optical vibrations of monolayer TMDs, developing a generalized continuum approach and analyzing two-dimensional phonon dispersion curves. Model parameters are fitted from density functional perturbation theory calculations, providing an effective tool to describe the phonon dispersion curves of TMD monolayers. Additionally, the evaluation of intravalley Pekar-Frohlich and A(1)-homopolar mode deformation potential coupling mechanisms is carried out to study the effects of metal ions and chalcogen atoms on polaron mass and binding energy. Both mechanisms are argued to be necessary for a correct analysis of polaron properties and processes involving electron-phonon interaction.
Article
Multidisciplinary Sciences
Yujia Zhang, Minjian Lu, Zhendong Zhu, Yan Li, Haoyun Wei
Summary: Based on the enhancement factor of broadband SECARS excitation process, a novel Fano resonance plasmonic nanostructure is studied, which shows significant enhancement effect in a wide wavenumber region, covering most of the fingerprint region. This geometrically-tunable Fano plasmonic nanostructure provides a way to realize broadband-enhanced CARS, with potentials in single-molecular monitoring and high-selectivity biochemical detection.
SCIENTIFIC REPORTS
(2023)
Article
Chemistry, Physical
Love Bansal, Chanchal Rani, Tanushree Ghosh, Suchita Kandpal, Manushree Tanwar, Rajesh Kumar
Summary: In this study, fractal porous silicon (pSi) electrodes fabricated using metal-assisted chemical etching (MACE) technique were investigated for charge storage applications. The electrochemical performance of the pSi electrodes was studied and compared with c-Si electrodes. The results showed that the pSi electrodes exhibited more capacitive current flow, while the c-Si electrodes showed ohmic behavior. The calculated areal capacitance values at different scan rates were also moderate, suggesting that pSi could be a potential candidate for energy/charge storage electrodes.
Article
Physics, Applied
Arpit Kumar Singh, Sooraj Shiby, Anshu Sahu, Piyush Pachori, Manushree Tanwar, Rajesh Kumar, I. A. Palani
Summary: Graphene is highly sought after in device fabrication for its high conductivity and flexural strength. Laser patterning of polyimide for graphene synthesis has gained attention for its ability to create flexible devices. This study focused on optimizing laser pulse overlap to enhance the crystallinity and electrical resistivity of synthesized graphene.
JOURNAL OF PHYSICS D-APPLIED PHYSICS
(2023)
Article
Nanoscience & Nanotechnology
Tanushree Ghosh, Suchita Kandpal, Chanchal Rani, Love Bansal, Manushree Tanwar, Rajesh Kumar
Summary: In this study, a versatile and easily processible electrochromic device based on polyaniline-Viologen (PANI-EV) was reported. The electrodes were individually characterized and the device showed improved electrochromic performance with fast switching time and good cycle life. The device could switch in visible, IR, and NIR regions with low bias voltage.
ADVANCED ELECTRONIC MATERIALS
(2023)
Article
Nanoscience & Nanotechnology
Sayantan Sarkar, Tanushree Ghosh, Argha Chakrobarty, Jagannath Majhi, Probal Nag, Anasuya Bandyopadhyay, Sivaranjana Reddy Vennapusa, Rajesh Kumar, Suman Mukhopadhyay
Summary: Here, a redox-active multifunctional ionic porous organic polymer iPOP-Bpy with exchangeable Br- ions, incorporating viologen as a redox-active building block, is designed and synthesized. The material exhibits excellent iodine uptake capacity in vapor phase (540 wt %) as well as in organic (1009.77 mg g(-1)) and aqueous phases (3921.47 mg g(-1)) with very fast adsorption kinetics. It also functions as a solid-state NH3 vapor sensor, showing rapid color switching in the presence of NH3 vapor. Moreover, it is used as a p-type complementary electrochromic electrode and shows promising performance for fabricating power-efficient solid-state electrochromic devices.
ACS APPLIED MATERIALS & INTERFACES
(2023)
Article
Chemistry, Physical
Manushree Tanwar, Chanchal Rani, Suchita Kandpal, Tanushree Ghosh, Puspen Mondal, Rajesh Kumar
Summary: This study reports the coexistence of intermediate amorphous-like and nanocrystalline phases in a silicon wafer fabricated using metal-assisted chemical etching. In addition, the origin of amorphous-like features in the Raman spectrum from porous silicon is established using spatial Raman spectroscopy and validated using longitudinal Raman spectro-microscopy. The coexisting a-Si/nanocrystalline Si phases are characterized using SEM, TEM, XRD, and Raman spectro-microscopy, which reveal structural variation in fractal Si obtained because of porosification.
JOURNAL OF PHYSICAL CHEMISTRY C
(2023)
Review
Chemistry, Physical
Suchita Kandpal, Tanushree Ghosh, Chanchal Rani, Anjali Chaudhary, Jinwoo Park, Pooi See Lee, Rajesh Kumar
Summary: Significant development in science and technology has occurred to meet the rising energy demands, particularly in response to environmental concerns associated with fossil fuels. Electrochromic devices, which combine energy conversion with color modulation, hold great promise for energy storage and saving purposes in buildings and vehicles, and can operate similarly to batteries and supercapacitors.
ACS ENERGY LETTERS
(2023)
Article
Chemistry, Multidisciplinary
Bhumika Sahu, Tanushree Ghosh, Suchita Kandpal, Love Bansal, Chanchal Rani, Hem Chandra Jha, Rajesh Kumar
Summary: Herbal electronics is an emerging field that focuses on the optical and electrical properties of herbal materials for potential electronic applications. This study investigates the optical properties of turmeric and henna extract solutions through absorption and luminescence spectroscopies. The analysis reveals that when the two solutions are mixed and excited by a blue/UV LED, they emit yellow light. The emission color is quantitatively evaluated using CIE color chart and the PL quantum yield is calculated. A simple setup demonstrates the yellow emission using a blue LED (400 nm) and the mixture solution, achieving a quantum yield of approximately 5%.
Article
Nanoscience & Nanotechnology
Ranjeev Kumar Parashar, Suchita Kandpal, Nila Pal, Debashree Manna, Bhola Nath Pal, Rajesh Kumar, Prakash Chandra Mondal
Summary: This study reports the coexistence of bistate electrochromic and single-resistor memory functions in a novel viologen. A high-performance electrochromic function is achieved by combining viologen with polythiophene. The random-access memory devices exhibit distinct low and high resistive states, bipolar and nonvolatile characteristics, and have good performances and Write-Read-Erase functions. This discovery could boost the development of multifunctional, smart, wearable, flexible, and low-cost optoelectronic devices.
ACS APPLIED MATERIALS & INTERFACES
(2023)
Article
Biochemistry & Molecular Biology
Chinmaya Kumar Patel, Chanchal Rani, Rajesh Kumar, Tushar Kanti Mukherjee
Summary: Protein aggregation and inactivation during surface immobilization hinder analytical applications in biotechnology. However, biomolecular condensates of active human serum transferrin (Tf) can prevent surface-induced fibrillation and maintain the native conformation of phase-separated Tf for a month. The condensates promote homotypic liquid-liquid phase separation (LLPS) through hydrophobic interactions, without undergoing a solid-like phase transition. These liquid-like condensates also inhibit surface-induced fibrillation, protecting the biomolecules from denaturation and aggregation. This study sheds light on the functional aspect of protein condensates and their potential applications in cell physiology and biotechnology.
Article
Chemistry, Physical
Sonam Rani, Manushree Tanwar, Chanchal Rani, Ravi Bhatia, Rajesh Kumar, I. Sameera
Summary: Raman spectroscopy was used to investigate the structure and vibrational properties of MoS2 nanoflowers. The study observed a softening of the E-2g(1) and A(1g) modes with increasing temperature, and found a linear relationship between these modes and temperature. Using a semiquantitative model, the study quantified the contributions of true anharmonicity and quasi-harmonicity to the temperature-dependent Raman shifts. It was observed that true anharmonicity had a greater influence, while the thermal expansion coefficient played a major role in the quasi-harmonic contribution. The study also demonstrated the variation in quasi-harmonicity behavior with temperature.
JOURNAL OF PHYSICAL CHEMISTRY C
(2023)
Article
Chemistry, Physical
Deb Kumar Rath, Chanchal Rani, Love Bansal, Suchita Kandpal, Tanushree Ghosh, Bhumika Sahu, Rajesh Kumar
Summary: A study on the size-dependent variation in Raman spectral parameters of silicon (Si) has been conducted. It has been found that the peak position and peak width of acoustic phonons show opposite trends with the size of Si nanoclusters, while the behavior of optic phonons is different. The differences between acoustic and optic phonon branches are explained through correlation analysis.
JOURNAL OF PHYSICAL CHEMISTRY C
(2023)
Article
Chemistry, Multidisciplinary
Deepali Aswal, Priyanka Bamola, Chanchal Rani, Saurabh Rawat, Abhinav Bhatt, Sandeep Chhoker, Mohit Sharma, Charu Dwivedi, Rajesh Kumar, Himani Sharma
Summary: This study focuses on the enrichment of photocatalytic activity by different WS2-based heterostructures, and investigates the impact of interfacial interaction. The results show that the 2D-2D MoS2/WS2 heterostructure exhibits the highest catalytic activity, which is attributed to its higher conductivity and better charge separation.
Article
Energy & Fuels
Lalan K. Singh, Rajesh Kumar, Anoop K. Gupta, A. K. Sharma, Satyam Panchal
Summary: Given the rising pollution index worldwide and the significant contribution of transportation vehicles, researchers have shifted their focus towards clean and renewable energy sources. Electric vehicles (EVs) powered by rechargeable lithium-ion batteries offer a promising solution in developing environmentally friendly vehicles. However, optimal battery performance requires the selection of a specific temperature range. In this study, a battery thermal management system (BTMS) utilizing encapsulated phase change material (PCM) and forced convective air cooling was numerically investigated using electrochemical-thermal modeling. The study examined the effect of increasing cell number on cooling performance and thermal uniformity at different discharge rates. The results provide valuable insights into temperature distribution, cell temperature, and thermal uniformity, and establish a predictive correlation for estimating average and maximum cell temperature under various conditions. Additionally, a comparative analysis of results based on different locations of PCM encapsulation is presented for optimization purposes.
JOURNAL OF ENERGY STORAGE
(2023)
Article
Energy & Fuels
Devesh K. Pathak, Tanushree Ghosh, Rajesh Kumar
Summary: In the field of electrochromic supercapacitors, active chromophores are introduced to reduce energy consumption and create power-efficient devices. By using a bi-layer stacked film of two different metal oxides (NiO@Co3O4), the simultaneous effect of chromic modulation and energy storage is achieved. The stacking of the film alters their suppressed resultant energy levels, resulting in less charge transfer resistance in an electrochemical cell. The fabricated electrodes display dominant capacitive behavior in an alkaline medium, forming an electric double layer at the electrode/electrolyte interface. The intercalation/de-intercalation of ions during charging changes the oxidation state of metals at the electrode surface and produces a finite chromic modulation. An interplay between the chromic modulation (eta CE = 27.5 cm2/C) and its capacitive performance (158 F/g) has been identified. Finally, the electrode is also tested as a counter electrode and shows improved electrochromic performance with a small organic viologen material.
JOURNAL OF ENERGY STORAGE
(2023)
Article
Chemistry, Physical
Sergey Yu. Ketkov, Sheng-Yuan Tzeng, Elena A. Rychagova, Anton N. Lukoyanov, Wen-Bih Tzeng
Summary: Metallocenes, including methylcobaltocene, play important roles in various fields of chemistry. The ionization energy and vibrational structure of (Cp ')(Cp)Co can be influenced by introducing methyl substituents. The mass-analyzed threshold ionization spectrum and DFT calculations provide accurate information about the properties and transformations of (Cp ')(Cp)Co.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS
(2024)
Review
Chemistry, Physical
Qifeng Mu, Jian Hu
Summary: Polymer mechanochemistry has experienced a renaissance due to the rapid development of mechanophores and principles governing mechanochemical transduction or material strengthening. It has not only provided fundamental guidelines for converting mechanical energy into chemical output, but also found applications in engineering and smart devices.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS
(2024)
Article
Chemistry, Physical
Da Hye Yang, Francesco Ricci, Fredrik L. Nordstrom, Na Li
Summary: Through systematic evaluation of the oiling-out behavior of procaine, we identified both stable and metastable liquid-liquid phase separation, and established phase diagrams to assist in rational selection of crystallization strategies.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS
(2024)
Article
Chemistry, Physical
Vikki Anand Varma, Simmie Jaglan, Mohd Yasir Khan, Sujin B. Babu
Summary: Designing engineering structures like nanocages, shells, and containers through self-assembly of colloids is a challenging problem. This work proposes a simple model for the subunit, which leads to the formation of monodispersed spherical cages or containers. The model with only one control parameter can be used to design cages with the desired radius.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS
(2024)
Article
Chemistry, Physical
Hainan Jiang, Yaolong He, Xiaolin Li, Zhiyao Jin, Huijie Yu, Dawei Li
Summary: The cycling lifespan and coulombic efficiency of lithium-ion batteries are crucial for high C-rate applications. The Li-ion concentration plays a crucial role in determining the mechanical integrity and structural stability of electrodes. This study focuses on graphite as the working electrode and establishes an experimental system to investigate the mechanical properties of composite graphite electrode at different C-rates. Considering the effect of Li-ion concentration in stress analysis is found to be significant.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS
(2024)
Article
Chemistry, Physical
Zhiye Wang, Yunchuan Li, Mingjun Sun
Summary: This study investigates the influence of intramolecular pi-pi interactions on the electronic transport capabilities of molecules. By designing and analyzing three pi-conjugated molecules, the researchers observe that different pi-conjugated structures have varying effects on electron transport. The findings provide a theoretical foundation for designing single-molecule electronic devices with multiple electron channels based on intramolecular pi-pi interactions.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS
(2024)
Article
Chemistry, Physical
Yuandong Xu, Haoyang Feng, Chaoyang Dong, Yuqing Yang, Meng Zhou, Yajun Wei, Hui Guo, Yaqing Wei, Jishan Su, Yingying Ben, Xia Zhang
Summary: Hollow MoS2 cubes and spheres were successfully synthesized using a one-step hydrothermal method with the hard template method. The hollow MoS2 cubes exhibited higher specific capacitance and energy density compared to the hollow MoS2 spheres. The symmetrical supercapacitors assembled with these hollow structures showed good performance and high capacity retention after multiple cycles. These findings suggest that controlling the pore structure and surface characteristics of MoS2 is crucial for enhancing its electrochemical properties.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS
(2024)
Article
Chemistry, Physical
Ainhoa Oliden-Sanchez, Rebeca Sola-Llano, Joaquin Perez-Pariente, Luis Gomez-Hortiguela, Virginia Martinez-Martinez
Summary: The combination of photoactive molecules and inorganic structures is important for the development of advanced materials in optics. In this study, bulky dyes were successfully encapsulated in a zeolitic framework, resulting in emission throughout the visible spectrum.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS
(2024)
Article
Chemistry, Physical
Miaomiao Zhang, Cunyuan Pei, Qiqi Xiang, Lintao Liu, Zhongxu Dai, Huijuan Ma, Shibing Ni
Summary: The design of a solid electrolyte interphase (SEI) plays a crucial role in improving the electrochemical performance of anode materials. In this study, lithium difluoro(oxalate)borate (LiDFOB) is used as an electrolyte additive to form a protective SEI film on Li3VO4 (LVO) anodes. The addition of LiDFOB results in a dense, uniform, stable, and LiF-richer SEI, which enhances the Li-ion storage kinetics. The generated SEI also prevents further decomposition of the electrolyte and maintains the morphology of LVO anodes during charge/discharge processes. This work demonstrates the effectiveness of LiDFOB as a multi-functional additive for LiPF6 electrolytes and provides insights into SEI construction for high-performance LVO anodes.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS
(2024)
Article
Chemistry, Physical
B. V. Andryushechkin, T. V. Pavlova, V. M. Shevlyuga
Summary: The atomic structure of the Ag(111)-p(4 x 4)-O phase was reexamined and two phases with the same periodicity were discovered. It was demonstrated that the accepted Ag6 model is incompatible with high-resolution oxygen-sensitive STM images.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS
(2024)
Article
Chemistry, Physical
S. L. Romo-Avila, D. Marquez-Ruiz, R. A. Guirado-Lopez
Summary: In this study, we used density functional theory (DFT) calculations to investigate the interaction between model graphene oxide (GO) nanostructures and chlorine monoxide ClO. We aimed to understand the role of this highly oxidizing species in breaking C-C bonds and forming significant holes on GO sheets. Our results showed that C-C bonds in a single graphene oxide sheet can be broken through a simple mechanism involving the dissociation of two chemically attached ClO molecules. The formation of carbonyl groups and holes on the GO surface was also observed. This study provides important insights into the degradation of carbon nanotubes and the stability of GO during the myeloperoxidase (MPO) catalytic cycle.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS
(2024)
Article
Chemistry, Physical
Alberto Garcia-Fernandez, Birgit Kammlander, Stefania Riva, Hakan Rensmo, Ute B. Cappel
Summary: In this study, the X-ray stability of five different lead halide perovskite compositions (MAPbI3, MAPbCl3, MAPbBr3, FAPbBr3, CsPbBr3) was investigated using photoelectron spectroscopy. Different degradation mechanisms and resistance to X-ray were observed depending on the crystal composition. Overall, perovskite compositions based on the MA+ cation were found to be less stable than those based on FA+ or Cs+. Metallic lead formation was most easily observed in the chloride perovskite, followed by bromide, and very little in MAPbI3. Multiple degradation processes were identified for the bromide compositions, including ion migration, formation of volatile and solid products, as well as metallic lead. CsBr was formed as a solid degradation product on the surface of CsPbBr3.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS
(2024)
Article
Chemistry, Physical
Timofei Rostilov, Vadim Ziborov, Alexander Dolgoborodov, Mikhail Kuskov
Summary: The shock-loading behavior of nanomaterials is investigated in this study. It is found that shock compaction waves exhibit a distinct two-step structure, with the formation of faster precursor waves that travel ahead of the main compaction waves. The complexity of the shock Hugoniot curve of the tested nanomaterial is described, and the effect of initial porosity on the compressed states is demonstrated.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS
(2024)
Article
Chemistry, Physical
Sergey S. Nikitin, Alexander D. Koryakov, Elizaveta A. Antipinskaya, Alexey A. Markov, Mikhail V. Patrakeev
Summary: The stability of La1/3Sr2/3Fe1-xMnxO3-delta, a perovskite-type oxide, under reducing conditions is dependent on the manganese content. Increasing the manganese content leads to a decrease in stability. The behavior of iron and manganese in the oxide shows distinct differences, which can be attributed to the difference in the enthalpy of oxidation reactions. Additionally, the change in the La/Sr ratio affects the concentration of iron and manganese ions.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS
(2024)
Article
Chemistry, Physical
Mosayeb Naseri, Shirin Amirian, Mehrdad Faraji, Mohammad Abdur Rashid, Maicon Pierre Lourenco, Venkataraman Thangadurai, D. R. Salahub
Summary: Inspired by the successful transfer of freestanding ultrathin films of SrTiO3 and BiFeO3, this study assessed the structural stability and investigated the electronic, optical, and thermoelectric properties of a group of two-dimensional perovskite-type materials called perovskenes. The findings revealed that these materials are wide bandgap semiconductors with potential application in UV shielding. Moreover, they exhibit better electrical and thermal conductivity at high temperatures, enabling efficient power generation in thermoelectric devices.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS
(2024)