Article
Chemistry, Multidisciplinary
Bintian Zhang, Eathen Ryan, Xu Wang, Weisi Song, Stuart Lindsay
Summary: DNA molecular wires have been extensively studied, while the same is not true for proteins. In this study, a series of consensus tetratricopeptide repeat (CTPR) proteins were synthesized and studied, and it was found that their conductance exceeded that of the canonical molecular wire oligo(phenylene-ethylenene). The decay of conductance with length in the protein followed an exponential pattern, characteristic of quantum tunneling, and a square-law dependence on length, characteristic of weakly driven hopping. Measurements of the energy dependence of the decay length ruled out the quantum tunneling case, and a resonance in the carrier injection energy showed alignment with the Fermi energy of the electrodes.
Article
Chemistry, Physical
Stefan Kraus, Alexander Herman, Felix Huttmann, Marco Bianchi, Raluca-Maria Stan, Ann Julie Holt, Shigeru Tsukamoto, Nico Rothenbach, Katharina Ollefs, Jan Dreiser, Ken Bischof, Heiko Wende, Philip Hofmann, Nicolae Atodiresei, Thomas Michely
Summary: Sandwich-molecular wires consisting of europium and cyclooctatetraene were grown on a graphene template and their band structure and magnetic properties were investigated. The wires exhibit a unique band structure and an easy-axis magnetization along the wire direction.
JOURNAL OF PHYSICAL CHEMISTRY C
(2022)
Article
Construction & Building Technology
Li He, Tengfei Li, Dongwang Zhong, Haohao Tao, Yuesen Peng, Shasha Chen
Summary: This study analyzes the blast resistance in TPMS sandwich panel structures with a cellular structure, and verifies the effectiveness of the finite element model through explosion tests and experimental data. The results of the study show that different TPMS configurations and panel thickness have a significant effect on the deformation and energy absorption of the sandwich panel. The findings of this study are of great significance in promoting the application of TPMS sandwich structures in blast-resistant structures.
Article
Chemistry, Physical
Jianjian Song, Jianglin Zhu, Zhaoyong Wang, Gang Liu
Summary: This paper investigates the influence of transannular pi-pi interaction on the carrier transport in molecular wires using the STM break junction technique. It is found that the carrier transport features of these molecular wires can be systematically controlled through the transannular pi-pi interaction.
Article
Chemistry, Physical
Guang Yang, Huiyang Zhang, Yijun Yang, Yudi Wang, Xinzi Xv, Xinli Zhao, Lijuan Meng, Xiaojing Yao, Xiuyun Zhang, Yongjun Liu
Summary: The study systematically investigated a series of one-dimensional transition metal-anthracene sandwich molecular wires, revealing strong ferromagnetic properties in most cases and identifying a FM half-metal and FM quasi HMs. The choice of transition metal atoms affects the binding energy. Some molecular lines also exhibit good spin transport performance.
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY
(2022)
Article
Chemistry, Multidisciplinary
Jesus Valdiviezo, Paulina Rocha, Anastazia Polakovsky, Julio L. Palma
Summary: In the study, the conductance of acene derivatives connected to gold electrodes was calculated using density functional theory (DFT) combined with the nonequilibrium Green's function (NEGF) formalism. It was found that the systems exhibit near length-independent conductance and can show an increase with molecular length, depending on the connection to the electrodes. The analysis attributes this behavior to the decrease of the HOMO-LUMO gap with length, shifting the transmission peaks near the Fermi level.
Article
Chemistry, Physical
Changcun Li, Xiaoqi Lan, Peipei Liu, Jingkun Xu, Qinglin Jiang, Congcong Liu, Cheng Liu, Fengxing Jiang
Summary: Interface control is regarded as an effective means to optimize the thermoelectric performance of inorganic/organic composites. This study proposes a core/hybrid-shell strategy to tune the energy barrier of the inorganic/organic core/shell nanowire interface, resulting in substantial improvement in power factor and reduction in thermal conductivity. The prepared core/hybrid-shell composites demonstrate good air-stability and flexibility, and the TE devices based on them yield excellent output properties, showing great potential for low-power wearable electronics.
Article
Nanoscience & Nanotechnology
Pengfei Zhao, Ruimin Zhang, Yanhong Tong, Xiaoli Zhao, Tao Zhang, Xue Wang, Qingxin Tang, Yichun Liu
Summary: This work fabricates an all-paper, shape-designable, reconfigurable capacitive pressure/proximity sensor using tissue paper as the dielectric and polypyrrole printer paper as the electrode/encapsulation, enabling flexible design of sensors for freely cuttable and foldable 2D and 3D shapes. The sensor demonstrates superior pressure-sensing performance and proximity-sensing ability, with potential applications in omnidirectional perception, stretchable sensors, and green electronics.
ACS APPLIED MATERIALS & INTERFACES
(2021)
Article
Materials Science, Multidisciplinary
Xiaowei Yu, Xiangtao Gong, Chinmoy Podder, Brandon Ludwig, I-Meng Chen, Wan Shou, Alexis Alvidrez, Genda Chen, Xian Huang, Heng Pan
Summary: The study introduces an additive manufacturing method for highly conductive sandwich-structured conductors with high-temperature processibility and versatility in applicable substrates. High annealing temperature contributes to improved electronic conductivity and interfacial bonding between the layers. The sandwich-structured conductors can be transferred to various flexible and stretchable substrates through a thiol-epoxy bonding process, exhibiting highly retained electronic conductivity under deformations.
ADVANCED ENGINEERING MATERIALS
(2021)
Article
Engineering, Mechanical
Tran Phuong, Chenxi Peng
Summary: Sandwich composite panels constructed from TPMS unit cells and metallic facets were numerically investigated for their dynamic behaviors under extreme loadings. The finite element analysis simulates the deformation and material response, demonstrating the effects of design parameters on blast resistances.
JOURNAL OF SANDWICH STRUCTURES & MATERIALS
(2021)
Review
Chemistry, Physical
Zhixing Lu, Jueting Zheng, Jie Shi, Biao-Feng Zeng, Yang Yang, Wenjing Hong, Zhong-Qun Tian
Summary: Molecular electronics is a promising field that has made breakthroughs in the fabrication and application of single-molecule devices. The combination of micro/nanofabrication techniques with other methods is being actively explored, with challenges and prospects in the fabrication of single-molecule devices being discussed.
Article
Nanoscience & Nanotechnology
Christian A. Nijhuis, Ziyu Zhang, Francis Adoah, Cameron Nickle, Senthil Kumar Karuppannan, Lejia Wang, Li Jiang, Anton Tadich, Bruce Cowie, Teddy Salim, Dong-Chen Qi, Damien Thompson, Enrique Del Barco
Summary: This paper investigates the mechanism of charge transport across molecular wires and finds that it can be switched between the normal and Marcus Inverted regions by tuning the molecule-electrode coupling strength and the tunneling distance. The results also suggest that weak molecule-electrode coupling is important for pushing the junctions into the Marcus Inverted Region.
ADVANCED ELECTRONIC MATERIALS
(2023)
Article
Chemistry, Physical
T. Glaser, M. Tripp, J-N Luy, R. Tonner-Zech, U. Koert, M. Durr
Summary: The adsorption behavior of benzyne on the Si surface was investigated using various experimental techniques and computational calculations. The results show that benzyne preferentially adsorbs on one dimer of the Si surface via the strained triple bond, forming a covalent bond with the surface. As the coverage increases, the benzyne molecules primarily adsorb along the dimer rows and align in the same direction on stepped surfaces.
Review
Biochemistry & Molecular Biology
Tanmay A. M. Bharat, Andriko von Kugelgen, Vikram Alva
Summary: The majority of prokaryotic cells are surrounded by a surface layer (S-layer) made of repeating lattice-forming proteins, which play various roles in cellular defense, cell-shape maintenance, and material import/export regulation. Recent advancements in structural and cell biology techniques have improved our understanding of S-layer structure and assembly, uncovering shared assembly principles and a potential molecular framework for understanding the structural organization of S-layer proteins in bacteria and archaea.
TRENDS IN MICROBIOLOGY
(2021)
Article
Materials Science, Multidisciplinary
Fabian Rueger, Michael Keusgen, Doru Vornicescu
Summary: The study increases the surface area of surface plasmon resonance (SPR) sensing by loading gold nanoparticles onto gold-coated chips, enabling rapid and sensitive detection of biomolecules. The successful loading of streptavidin onto the nanoparticles allows convenient immobilization of various biotinylated molecules, while also avoiding protein denaturation caused by close contact to gold surfaces.
PHYSICA STATUS SOLIDI A-APPLICATIONS AND MATERIALS SCIENCE
(2021)
Article
Multidisciplinary Sciences
Huimin Yang, Shibo Xi, Na Guo, Mu Wang, Lingmei Liu, Pin Lyu, Xiaolong Yu, Jing Li, Haomin Xu, Xiao Hai, Zejun Li, Xinzhe Li, Tao Sun, Xiaoxu Zhao, Yu Han, Wei Yu, Jie Wu, Chun Zhang, Honghan Fei, Ming Joo Koh, Jiong Lu
Summary: A ligand exchange strategy is used to exfoliate bulk cuprate crystals into atomically thin 2D cuprate layers, which have periodic unsaturated copper single sites that promote efficient oxidative Chan-Lam coupling. The catalytic active sites in the 2D cuprate layers are found to be coordinatively unsaturated CuO4(II) single sites and Cu(I) species, which are stable and recyclable in reactions and show good performance in complex molecule derivatization.
NATIONAL SCIENCE REVIEW
(2023)
Article
Engineering, Electrical & Electronic
Zhuoling Jiang, Tong Su, Cherq Chua, L. K. Ang, Chun Zhang, Liemao Cao, Yee Sin Ang
Summary: 2D layered dielectrics provide a compelling approach for designing next-generation compact nanoelectronics. We investigate the interface properties between LaOX and 2D semiconductors MS2 using DFT simulations, revealing large band offsets between 1.12 and 2.40 eV. Based on electron emission model, LaOX is shown to be an excellent companion dielectric for NMOS and PMOS applications with low leakage currents. The presence of interfacial tunneling potential barrier further suppresses the leakage current.
IEEE TRANSACTIONS ON ELECTRON DEVICES
(2023)
Article
Chemistry, Physical
Yun Chen, Jingyu He, Shijie Wang, Yuan Ping Feng, Jun Zhou
Summary: This work reports a new type of Janus structures, Janus electrenes with different cation layers. By substituting one of the two zirconium cation layers in Zr2Cl2 with group I to III elements, nine Janus 2D materials have been generated, showing dramatically different electronic and magnetic properties. The results provide a new dimension of freedom to effectively tune the electronic and magnetic properties of electrenes, paving the way for novel applications.
JOURNAL OF ALLOYS AND COMPOUNDS
(2023)
Article
Chemistry, Multidisciplinary
Xiaocang Han, Jing-Yang You, Shengqiang Wu, Runlai Li, Yuan Ping Feng, Kian Ping Loh, Xiaoxu Zhao
Summary: Transition-metal trihalides MX3 belong to a family of novel 2D magnets with topological magnons and electromagnetic properties, showing great potential in next-generation spintronic devices. However, direct atomic-scale analysis of MX3 is challenging due to their air instability, making information on stacking-registry-dependent magnetism elusive. In this study, we report a nondestructive transfer method to realize intact transfer of bilayer MX3 and provide a full spectrum of stacking orders in MX3 with atomic precision, revealing their associated magnetic ground states. The study sheds light on the structural basis of diverse magnetic orders in MX3, paving the way for modulating magnetic couplings via stacking engineering.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
(2023)
Article
Materials Science, Multidisciplinary
Saba Khan, Yuan-Ping Feng, Nacir Tit
Summary: Designing 2D materials with half-metallicity is crucial for spintronic devices. By using manganese as a catalyst combined with specific metal atoms, it is possible to achieve half-metallicity, which is attributed to the ferromagnetic coupling interactions between the catalysts and periodic boundaries.
Article
Chemistry, Multidisciplinary
Lizhu Ren, Chenghang Zhou, Xiaohe Song, Herng Tun Seng, Liang Liu, Chaojiang Li, Tieyang Zhao, Zhenyi Zheng, Jun Ding, Yuan Ping Feng, Jingsheng Chen, Kie Leong Teo
Summary: Electrically manipulating magnetic moments by spin-orbit torque (SOT) has potential applications in magnetic memories and logic devices. In this study, highly textured, polycrystalline Heusler alloy MnxPtyGe (MPG) films were found to exhibit reversible switching of magnetization with low switching current density. Additionally, MPG shows a memristive characteristic and the ability for deterministic field-free switching of magnetization.
Article
Materials Science, Multidisciplinary
Wadha Alfalasi, Yuan Ping Feng, Nacir Tit
Summary: The aim of this study is to search/design transition-metal TM doped transition-metal dichalcogenide TMD monolayers that can exhibit half-metallicity. The investigation showed positive results on (Mn, Fe, and Ni)-doped MoS2 MLs and (V, Mn, Fe, and Co)-doped MoSe2 in smaller sample sizes of 4 x 4, 5 x 5, and 6 x 6 primitive cells. The disappearance of half metallicity in larger samples can be attributed to the existence of ferromagnetic-coupling interactions and a drastic change in magnetization.
Article
Engineering, Electrical & Electronic
Jiajun Linghu, Tingting Song, Tong Yang, Jun Zhou, Kimyong Lim, Chornghaur Sow, Ming Yang, Yuanping Feng, Xuezhi Wang
Summary: In this study, various stable semiconducting Zn-C compounds were discovered through particle swarm optimization and first-principles calculations. These compounds have stronger covalent Zn-C bonding characteristics compared to the metal rocksalt zinc carbide. Importantly, three of the compounds have direct or quasi-direct band gaps within the desirable energy range for optoelectronic applications. The electronic transitions across these band gaps contribute to the blue and near-infrared light emissions of carbon-doped ZnO.
MATERIALS SCIENCE IN SEMICONDUCTOR PROCESSING
(2023)
Article
Chemistry, Multidisciplinary
Lizhu Ren, Liang Liu, Xiaohe Song, Tieyang Zhao, Xiangjun Xing, Yuan Ping Feng, Jingsheng Chen, Kie Leong Teo
Summary: Magnetic Weyl semimetals (MWSMs) have unconventional transport phenomena and can be electrically manipulated by spin-orbit torque (SOT). High-quality Co2MnGa film is confirmed to have MWSM state, and its magnetization and topology can be controlled electrically. Current-induced SOT switches the topological magnetic state of Co2MnGa in both 180-degree and 90-degree manners. This work opens up more possibilities for spintronic applications based on topological materials.
Article
Nanoscience & Nanotechnology
Kah-Meng Yam, Yongjie Zhang, Na Guo, Zhuoling Jiang, Hui Deng, Chun Zhang
Summary: By using computational modeling and calculations, we have proposed a new class of two-dimensional atomically thin crystals called 2D graphitic metal carbides (g-MCs), which contain metal-C3 (MC3) moieties periodically distributed in a graphenic lattice. These g-MCs exhibit high stability due to carbon-backbone-mediated metal-metal interactions. The tunability of electronic properties and the exceptional electrocatalytic performance of g-MnC towards CO2 reductive reaction for formic acid formation suggest great potential for various applications.
Article
Chemistry, Physical
Zhuoling Jiang, Kah-Meng Yam, Yee Sin Ang, Na Guo, Yongjie Zhang, Hao Wang, Chun Zhang
Summary: Based on first-principles calculations, this study reports the observation of half-integer conductance quantization in Cobalt-fulvalene sandwich nanowire. It reveals the important role of fulvalene molecules in influencing the electrical conductivity of Cobalt atoms, and demonstrates the potential application of this nanowire as a spin filter or spin valve device in spintronics technology.
NPJ COMPUTATIONAL MATERIALS
(2023)
Article
Materials Science, Multidisciplinary
Yi-Ming Zhao, Chun Zhang, Sunmi Shin, Lei Shen
Summary: Two-dimensional bilayer structures, such as bilayer hexagonal boron nitride (h-BN), exhibit unique properties that can be manipulated for potential applications in slidetronics. This study investigates the thermal conductivity of sliding bilayer h-BN structures and demonstrates that the lattice configurations and strain can influence the thermal transport behavior. The results show that boron head-to-head stacking (B-B) structures have lower thermal conductivity compared to nitrogen on the top of boron stacking (B-N) structures.
JOURNAL OF MATERIALS CHEMISTRY C
(2023)
Article
Chemistry, Physical
Zishen Wang, Jing-Yang You, Chuan Chen, Jinchao Mo, Jingyu He, Lishu Zhang, Jun Zhou, Kian Ping Loh, Yuan Ping Feng
Summary: The coexistence of charge density waves (CDWs), superconductivity, and nontrivial topology in monolayer 1H-MSe2 (M = Nb, Ta) has been observed, triggered by momentum-dependent electron-phonon coupling through electron doping. New 2 x 2 CDW phases with nontrivial topology, Dirac cones, and van Hove singularities emerge at a critical electron doping concentration. These 2 x 2 CDW phases are also found to be superconducting. This discovery provides insights into the engineering of nontrivial electronic characters and offers a platform to modulate different quantum states.
NANOSCALE HORIZONS
(2023)
Article
Chemistry, Physical
Jun Zhou, Zishen Wang, Shijie Wang, Yuan Ping Feng, Ming Yang, Lei Shen
Summary: This study reports a novel charge density wave that generates 2D ferromagnetism instead of suppressing it by forming interstitial anionic electrons as the charge modulation mechanism. This transition introduces a new magnetic form of CDWs, offering promising opportunities for exploring novel fundamental physics and advanced spintronics applications.
NANOSCALE HORIZONS
(2023)
Article
Physics, Multidisciplinary
Zishen Wang, Chuan Chen, Jinchao Mo, Jun Zhou, Kian Ping Loh, Yuan Ping Feng
Summary: This study proposes an ab initio method to accurately describe Fermi surface nesting and electron-phonon coupling (EPC), and systematically investigates their roles in the formation of charge density wave (CDW). The results show that momentum-dependent EPC leads to softening of phonon frequencies, which become imaginary (phonon instabilities) at CDW vectors. Moreover, including EPC in the mean-field model is necessary to correctly predict the distribution of electron instabilities and CDW gap opening. These findings highlight the crucial role of EPC in CDW formation. The analytical approach used in this study is applicable to other CDW systems.
PHYSICAL REVIEW RESEARCH
(2023)