Article
Chemistry, Physical
Olawale Olaoluwa Dada, Sina Karimzadeh, Patrick Ehi Imoisili, Tien-Chien Jen
Summary: A systematic computational investigation was conducted to explore the factors and mechanisms that determine the catalytic activity of molybdenum phosphide (MoP). The presence of phosphorus was found to enhance the intrinsic catalytic activity and proton adsorption kinetics of the (100) surface of MoP nanoparticles, making it highly suited for the hydrogen evolution reaction (HER) analogues to platinum. This study highlights the importance of phosphorizing and surface faceting in improving the catalytic performance of transition metals.
INTERNATIONAL JOURNAL OF HYDROGEN ENERGY
(2023)
Article
Nanoscience & Nanotechnology
Yan Zang, Baopeng Yang, An Li, Chengan Liao, Gen Chen, Min Liu, Xiaohe Liu, Renzhi Ma, Ning Zhang
Summary: A heterojunction of cobalt sulfide and Mo2N is designed for efficient hydrogen evolution reactions in both acid and alkaline electrolytes. The Mo-S bonds formed at the interface result in considerably enhanced hydrogen evolution reaction activity. This study provides a feasible strategy for designing hetero-based electrocatalysts with a tuned highly active interface.
ACS APPLIED MATERIALS & INTERFACES
(2021)
Article
Chemistry, Physical
Shatila Sarwar, Ashraf Ali, Yifan Wang, Md. Robayet Ahasan, Ruigang Wang, Andrew J. Adamczyk, Xinyu Zhang
Summary: The study presents a rapid microwave-assisted synthesis approach to develop an efficient molybdenum sulfotelluride electrocatalyst supported on graphene, MoSxTey/Gr, with abundant interfaces for enhanced electrochemical reactivity. Among the synthesized nanocomposites, MoS0.46Te0.58/Gr demonstrates the best hydrogen evolution performance with low overpotential, small Tafel slope, and long-term stability. Density functional theory calculations reveal Mo enrichment as a promising strategy for electrocatalyst engineering, with highperforming active sites primarily consisting of exposed Mo atoms. Additionally, in a volcano plot analysis, MoS0.46Te0.58/Gr exhibits near thermoneutral catalytic activity at the apex.
Article
Materials Science, Multidisciplinary
Hailu Fan, Kuo Cao, Jinxiao Ba, Hui Cheng, Xianghai Yu, Aiying Song, Chengqun Xu, Yihua Wang, Donghua Fan
Summary: We reported a facile approach to fabricate molybdenum sulfide (MoS2) electrocatalyst with vanadium(V) introduction for improved catalytic performance. The morphology of prepared samples was characterized by SEM observation. The results showed that the appropriate amount of vanadium introduction effectively increased the crystallinity and formation of edge-terminated structure in MoS2 nanostructure. Furthermore, the conductivity of prepared samples was enhanced by incorporating a certain amount of graphene. The electrochemical performance of 20%V-MoS2 can be further improved by the introduction of appropriate graphene, exhibiting small resistance and excellent cycling stability in the acidic electrolyte.
MATERIALS SCIENCE AND ENGINEERING B-ADVANCED FUNCTIONAL SOLID-STATE MATERIALS
(2023)
Article
Chemistry, Multidisciplinary
Guangsheng Liu, Kunyapat Thummavichai, Xuefeng Lv, Wenting Chen, Tingjun Lin, Shipeng Tan, Minli Zeng, Yu Chen, Nannan Wang, Yanqiu Zhu
Summary: A novel defect-rich ternary nanocomposite MoS2/rGO/NiS was synthesized, showing enhanced electrocatalytic activity and stability for hydrogen evolution reaction in a wide pH range through the introduction of other metal phases and carbon materials.Abundant heterogeneous interfaces, expanded interlayer spacings, and high conductivity of graphene oxide contributed to the excellent hydrogen evolution performance of the MoS2/rGO/NiS catalyst.
Article
Chemistry, Physical
Jagadis Gautam, Debabrata Chanda, Mikiyas Mekete Meshesha, Seok Gwon Jang, Bee Lyong Yang
Summary: Heterointerface engineering is a promising strategy for creating efficient catalysts by enhancing catalytic active centers and charge transfer capabilities. In this study, a novel heterostructure of manganese cobalt sulfide-molybdenum disulfide on nickel foam (MnCo2S4-MoS2/NF) was synthesized and showed accelerated charge transfer ability and multiple integrated active sites. The MnCo2S4-MoS2/NF display low overpotentials for HER and OER, surpassing commercial and previously reported catalysts, making them a potential candidate for overall water splitting.
JOURNAL OF COLLOID AND INTERFACE SCIENCE
(2023)
Article
Chemistry, Physical
Reza Andaveh, Alireza Sabour Rouhaghdam, Jianping Ai, Meysam Maleki, Kun Wang, Abdolvahab Seif, Ghasem Barati Darband, Jinyang Li
Summary: This study presents a high-performance bifunctional water (seawater) electrocatalyst, 3-D heterostructured MnCo/NiSe/NF, for hydrogen production through seawater electrolysis. The MnCo/NiSe catalyst exhibits excellent catalytic activity for both HER and OER in alkaline water and seawater, with a synergistic effect between MnCo and NiSe. The findings are supported by DFT-based modeling.
APPLIED CATALYSIS B-ENVIRONMENTAL
(2023)
Article
Chemistry, Physical
Yuan Tan, Yucheng Zhu, Xiaofei Cao, Yuhao Liu, Jiayuan Li, Zhong Chen, Jun Hu
Summary: This paper investigates the performance of hydrogen spillover-based binary catalysts under acidic conditions. By using material screening, 11 candidate catalysts with excellent hydrogen evolution reaction (HER) performance are found, and Pt1Ir1-MoS2 catalyst is successfully synthesized and verified to exhibit outstanding catalytic performance. The study reveals the key role of hydrogen spillover in efficient water splitting, providing a new paradigm for the discovery of widely applicable materials.
Article
Chemistry, Applied
Abhisek Majumdar, Golam Masud Karim, Pronoy Dutta, Heehyeon Lee, Sujit Kumar Deb, Anirban Sikdar, Youngtak Oh, Uday Narayan Maiti
Summary: Order/dis-order atomic arrangements in crystalline/amorphous structure complement each other in electro-catalysis. This study demonstrates the atomic rearrangement of crystalline oxide nanowire surface into an amorphous molybdenum sulfide shell, resulting in excellent hydrogen evolution activity. The developed catalyst shows competitive performance in various electrolytes, making it a promising universal catalyst.
Article
Chemistry, Physical
Fei-Fei Li, Zi-Ping Niu, Li-Xin Zhang
Summary: Molybdenum disulfide (MoS2) is considered a promising candidate for replacing Pt group noble metals as an efficient catalyst for the hydrogen evolution reaction, and the catalytic efficiency of 1T-phase MoS2 can be enhanced for HER. Oxygen-doped MoS2 may serve as a potential candidate catalyst with better performance than pure MoS2 according to differential Gibbs free energy analysis.
Article
Chemistry, Physical
Santiago Palencia-Ruiz, Denis Uzio, Christele Legens, Dorothee Laurenti, Pavel Afanasiev
Summary: Nanodispersed MoS2 and CoMoS2 materials with metastable 1T MoS2 phase were prepared using solvothermal technique and studied for their performance in electrocatalytic hydrogen evolution, thiophene hydrodesulfurization, and 1-pentene hydrogenation reactions. The role of different factors in stabilizing the 1T MoS2 phase was investigated, with ethylene glycol found to stabilize the polymorph. The presence of cobalt did not affect the stability of the 1T phase, but improved both HER and HDS performance by forming CoMoS species.
APPLIED CATALYSIS A-GENERAL
(2021)
Article
Chemistry, Physical
Jelena Rmus Mravik, Igor Milanovic, Sanja Milosevic Govedarovic, Ana Mrakovic, Ekaterina Korneeva, Ivana Stojkovic Simatovic, Sandra Kurko
Summary: Molybdenum disulfide (MoS2) is a promising noble metal-free catalyst for the hydrogen evolution reaction (HER). Various nanostructures of MoS2 exhibit noticeable catalytic activity, and low-energy ion irradiation can enhance the catalytic activity further by producing morphological changes and defects in the structure.
INTERNATIONAL JOURNAL OF HYDROGEN ENERGY
(2023)
Article
Chemistry, Physical
Shisheng Yuan, Yuhua Liu, Jiaqi Zheng, Mengyang Cui, Kaiwen Wang, Nan Li
Summary: Molybdenum carbide (Mo2C) with sulfur modification has been developed as an efficient catalyst for hydrogen evolution reaction (HER). The sulfur atoms replace a portion of the oxygen atoms on the surface of Mo2C, activating the surface and improving the HER performance. Theoretical studies suggest that the strong hydrogen bonding of Mo atoms in the oxide layer is the primary reason for impaired HER performance, and sulfur modification weakens the Mo-H bond, leading to enhanced HER activity.
JOURNAL OF ALLOYS AND COMPOUNDS
(2023)
Article
Engineering, Environmental
Sayyar Ali Shah, Li Xu, Rani Sayyar, Ting Bian, Zeyu Liu, Aihua Yuan, Xiaoping Shen, Iltaf Khan, Asif Ali Tahir, Habib Ullah
Summary: The growth of hierarchical MoS2 nanosheets on N-doped carbon encapsulated metal particles has resulted in a highly active electrocatalyst for hydrogen evolution reaction (HER). This catalyst exhibits excellent HER performance and long-term stability in acidic conditions, with the superior catalytic activity attributed to optimal electron transfer between nanoparticles leading to enhanced HER performance.
CHEMICAL ENGINEERING JOURNAL
(2022)
Article
Chemistry, Multidisciplinary
Ke Guo, Jinyu Zheng, Jianchun Bao, Yafei Li, Dongdong Xu
Summary: Surface modification of electrocatalysts is a key strategy for designing advanced nanocatalysts with improved electrocatalytic performance. This study develops highly dispersed amorphous molybdenum trisulfide-anchored Platinum nanodendrites (Pt-a-MoS3 NDs) as efficient hydrogen evolution electrocatalysts. The enhanced electrocatalytic activity of Pt catalysts is attributed to the highly dispersed a-MoS3, which acts as a preferred adsorption site for the efficient conversion of H+ to H2. Furthermore, the anchoring of highly dispersed clusters to Pt substrate significantly enhances the electrocatalytic stability.
Article
Energy & Fuels
Shashank Shekhar Mishra, Partha Kumbhakar, Subramanian Nellaiappan, Nirmal Kumar Katiyar, Raphael Tromer, Cristiano F. F. Wollner, Douglas S. S. Galvao, Chandra S. S. Tiwary, Chanchal Ghosh, Arup Dasgupta, Krishanu Biswas
Summary: Chemical exfoliation was used to synthesize atomically thin two-dimensional multicomponent alloy from a multicomponent quasicrystalline alloy, which exhibited excellent catalytic performance in alkaline water splitting. The ultrathin two-dimensional sheets had a large active surface area and a high number of active sites for bifunctional catalysis. Molecular dynamics and density functional theory simulations supported the experimental results.
Article
Materials Science, Ceramics
Arijit Jana, Manojit Das, Shivam Tiwari, Shaik Salam Basha, Abhay Raj Singh Gautam, Sushanta Kumar Panda, Rahul Mitra, Shobhit Kumar, Renjith Devasia, Chandra Sekhar Tiwary
Summary: Environment-friendly water-based SiC ceramic inks were developed using different size SiC powders, and the relation between SiC particle size and rheological properties was established. The additive manufacturing conditions for SiC were optimized, achieving a compressive strength of -1.21 MPa. The optimum sintering temperature (1400 degrees C) resulted in improved compressive strength of -80 MPa with a relative density of -81%. The current printing method can produce complex ceramic components that can be utilized for manufacturing complex aerospace components.
CERAMICS INTERNATIONAL
(2023)
Article
Materials Science, Composites
Manojit Das, Rajat Mishra, Palash Das, Sunil Kumar Kashyap, Sushanta Kumar Panda, Rahul Mitra, Peter Samora Owuor, Amit Arora, Chandra Sekhar Tiwary
Summary: In a 3D printed polymer composite, the orientation of reinforcement, distribution, and porosity greatly affect the mechanical properties. By adjusting printing conditions such as nozzle diameter and flow rates, we demonstrate precise control over the reinforcement orientation. Experimental observations show a direct correlation between reinforcement directionality, porosity, and mechanical properties with printing conditions.
COMPOSITES SCIENCE AND TECHNOLOGY
(2023)
Article
Chemistry, Physical
Partha Kumbhakar, Ashim Pramanik, Shashank Shekhar Mishra, Raphael Tromer, Krishanu Biswas, Arup Dasgupta, Douglas S. Galvao, Chandra Sekhar Tiwary
Summary: Various strategies have been developed to trap photons inside living cells for high-contrast imaging. One such strategy is the use of 3D-printed biomimetic architecture with localized surface plasmon resonance (LSPR) promoter. This study compares optical confinement in natural and 3D-printed photonic architectures and demonstrates that the 3D-printed fish scale with atomically thin quasicrystals (QCs) outperforms other 2D materials in terms of image contrast.
JOURNAL OF PHYSICAL CHEMISTRY C
(2023)
Article
Nanoscience & Nanotechnology
Manojit Das, Arijit Jana, Rajat Mishra, Swapan Maity, Pralay Maiti, Sushanta Kumar Panda, Rahul Mitra, Amit Arora, Peter Samora Owuor, Chandra Sekhar Tiwary
Summary: Direct ink writing (DIW) additive manufacturing is a versatile 3D printing technique that can print a variety of materials with well-engineered ink. DIW has great potential in tissue engineering for repairing and regenerating deformed or missing organs or tissues.
ACS APPLIED BIO MATERIALS
(2023)
Article
Nanoscience & Nanotechnology
Nitika Arya, Yadu Chandran, Arkaj Singh, Ravinder Sharma, Aditi Halder, Viswanath Balakrishnan
Summary: This article introduces a low-cost method for fabricating customizable supercapacitors and batteries. By directly pen writing MoS2 nanostructures onto various substrates, the fabrication of energy storage devices becomes simplified, affordable, and simple, advancing the development of energy storage devices.
ACS APPLIED MATERIALS & INTERFACES
(2023)
Article
Nanoscience & Nanotechnology
Partha Kumbhakar, Rushikesh S. Ambekar, Arko Parui, Ajit K. Roy, Debmalya Roy, Abhishek K. Singh, Chandra S. Tiwary
Summary: This work demonstrates the electrical-mechanical coupling phenomena by decorating piezoresponsive atomically thin ZnO nanosheets on a polymer surface using additive manufacturing technology. The output voltage response of the 3D-printed architecture can be regulated by external mechanical pressures. Energy generation is achieved by placing the 3D-printed fabric on a padded shoulder strap, utilizing the mechanical strength and flexibility of the coated structure. The improved charge transfer at the interface enhances the output performance of the 3D-printed fabric.
ACS APPLIED MATERIALS & INTERFACES
(2023)
Article
Physics, Applied
Sayan Prodhan, Kamlesh Kumar Chauhan, Tara Singha, Manobina Karmakar, Nikhilesh Maity, Renjith Nadarajan, Partha Kumbhakar, Chandra Sekhar Tiwary, Abhishek Kumar Singh, Manikoth M. Shaijumon, Prasanta Kumar Datta
Summary: Semiconductors based on group-VI 2D materials, such as bilayer selenium (Se), show potential for optoelectronic applications. This study investigates the carrier dynamics of bilayer 2D Se in one-photon and multi-photon absorption regimes. The results show that the carrier lifetime can be used to predict the photo-responsivity of 2D Se photo-detectors operating in the one-photon-absorption regime. Additionally, bilayer 2D Se exhibits a significant two-photon absorption cross section and can function as a sub-bandgap photo-detector. The study also reveals the dominant carrier recombination process in different absorption regimes, and suggests the possibility of using 2D Se as a saturable absorber material for passive Q-switching.
APPLIED PHYSICS LETTERS
(2023)
Article
Chemistry, Physical
Preeti Lata Mahapatra, Caique Campos de Oliveira, P. R. Sreeram, Sivaraj Kanneth Sivaraman, Suman Sarkar, Gelu Costin, Basudev Lahiri, Pedro Alves da Silva Autreto, Chandra Sekhar Tiwary
Summary: This study demonstrates the gas sensing properties of 2D rhodonite silicate extracted from natural mineral ore for hydrogen sulfide. The material shows high sensitivity and selectivity, and the sensors developed using it are stable. The findings suggest the potential use of environmentally stable natural silicate 2D materials as efficient replacements for conventional metal oxides for ultrasensitive sensors.
CHEMISTRY OF MATERIALS
(2023)
Article
Chemistry, Multidisciplinary
Trivender Kumar, Bandhana Devi, Aditi Halder, Rik Rani Koner
Summary: Efficient and cost-effective NiFe-LDHs materials were prepared through alkaline hydrolysis of NiFe-CPs precursors. The catalysts exhibited enhanced activity for oxygen evolution reaction (OER) and high performance for supercapacitor applications. The experimental findings suggest great potential for the development of NiFe-LDH based electrocatalysts in future.
Article
Nanoscience & Nanotechnology
Anjali Jayakumar, Rushikesh S. Ambekar, Preeti Lata Mahapatra, Appu Kumar Singh, Tarun Kumar Kundu, P. R. Sreeram, Rahul R. Nair, Chandra Sekhar Tiwary
Summary: This study investigates the enhancement of mechanical, thermal, and flexoelectric properties of 3D-printed carboxymethyl cellulose (CMC) by adding mechanically exfoliated hexagonal boron nitride (hBN). hBN acts as a rheology modifier and 2% hBN-reinforced CMC shows the highest apparent viscosity while 0.5% hBN/CMC film exhibits the highest mechanical and thermal stability. A flexoelectric energy harvester is fabricated using 3D-printed hBN/CMC composites.
ACS APPLIED NANO MATERIALS
(2023)
Article
Materials Science, Multidisciplinary
Astha Dixit, Manojit Das, Himanshu Singh, Sushanta Kumar Panda, Nicola M. Pugno, Nirmal Kumar Katiyar, Chandra Sekhar Tiwary
Summary: This study employed fused deposition modeling (FDM) printers to model and fabricate octopus-inspired suction cups. The compressive test proved that the inside cavity plays a significant role in enhancing strength due to stress distribution and is represented as a robust biomimetic design. The findings demonstrate that the naturally evolved octopus structure exhibits superior compressive strength, enhanced energy absorption, and the ability to generate negative pressure, rendering it highly suitable for gripping, suction, and shock-absorption applications.
ACS APPLIED POLYMER MATERIALS
(2023)
Article
Nanoscience & Nanotechnology
P. L. Mahapatra, A. K. Singh, R. Tromer, P. Kumbhakar, S. K. Sinha, B. Lahiri, T. K. Kundu, D. S. Galvao, C. S. Tiwary
Summary: In this study, a 2D spinel MgCr2O4 with high surface activity was synthesized by a liquid-phase exfoliation process. The fabricated flexoelectric device showed an electrical response up to -3V upon pressing and releasing the cell. The energy harvesting properties of 2D MgCr2O4 were explored by combining bending with other external energy sources.
MATERIALS TODAY NANO
(2023)
Article
Chemistry, Physical
Chetna Madan, Saumya R. Jha, Nirmal Kumar Katiyar, Arkaj Singh, Rahul Mitra, Chandra Sekhar Tiwary, Krishanu Biswas, Aditi Halder
Summary: This study reports a new high entropy alloy material that exhibits good electrocatalytic performance in zinc-air batteries. By adjusting the electronic and chemical properties of the material, the round-trip efficiency and stability of zinc-air batteries can be improved.
Article
Chemistry, Physical
Chinmayee Chowde Gowda, Raphael Tromer, Dharita Chandravanshi, Prafull Pandey, Kamanio Chattopadhyay, Douglas S. Galvao, Chandra Sekhar Tiwary
Summary: Low-dimensional transition metal chalcogenides (TMDCs) have shown potential as energy harvesters due to their structural change and high surface potential. A study on thin flakes of manganese di-telluride (MnTe2) demonstrated that a triboelectric nanogenerator (TENG) based on these flakes achieved high power density and sensitivity. The device also showed enhanced outputs through the introduction of strains.