Deobrat Singh
Postdoctoral position at Department of Physics and Astronomy; Materials Theory
- E-mail:
- deobrat.singh@physics.uu.se
- Visiting address:
- Ångströmlaboratoriet, Lägerhyddsvägen 1
- Postal address:
- Box 516
751 20 UPPSALA
More information is available to staff who log in.
Publications
Selection of publications
- Orbital hybridization-induced band offset phenomena in NixCd1-xO thin films (2020)
- High temperature-mediated rocksalt to wurtzite phase transformation in cadmium oxide nanosheets and its theoretical evidence (2019)
- Efficient and selective sensing of nitrogen-containing gases by Si2BN nanosheets under pristine and pre-oxidized conditions (2019)
- Two-Dimensional CH3NH3PbI3 with High Efficiency and Superior Carrier Mobility (2019)
- The influence of edge structure on the optoelectronic properties of Si2BN quantum dot (2019)
- Spin-entropy induced thermopower and spin-blockade effect in CoO (2019)
- Enhanced Optoelectronic and Thermoelectric Properties by Intrinsic Structural Defects in Monolayer HfS2 (2019)
- Effect of electric field on optoelectronic properties of indiene monolayer for photoelectric nanodevices (2019)
- Emergence of Si2BN Monolayer as Efficient HER Catalyst under Co-functionalization Influence (2019)
- An emerging Janus MoSeTe material for potential applications in optoelectronic devices (2019)
Recent publications
- Unveiling the catalytic potential of two-dimensional boron nitride in lithium-sulfur batteries (2024)
- Exploring the Potential of Substituted and Defected Magnesium Dichloride Monolayers for Optoelectronic Applications (2024)
- Structural Stability and Electronic Properties of 2D MXene Hf3C2F2 Monolayer by Density Functional Theory Approach (2023)
- Intrinsic insights to antimicrobial effects of Nitrofurantoin to multi drug resistant Salmonella enterica serovar Typhimurium ms202 (2023)
- Eldfellite NaV(SO4)2 as a versatile cathode insertion host for Li-ion and Na-ion batteries (2023)
All publications
Articles
- Unveiling the catalytic potential of two-dimensional boron nitride in lithium-sulfur batteries (2024)
- Exploring the Potential of Substituted and Defected Magnesium Dichloride Monolayers for Optoelectronic Applications (2024)
- Structural Stability and Electronic Properties of 2D MXene Hf3C2F2 Monolayer by Density Functional Theory Approach (2023)
- Intrinsic insights to antimicrobial effects of Nitrofurantoin to multi drug resistant Salmonella enterica serovar Typhimurium ms202 (2023)
- Eldfellite NaV(SO4)2 as a versatile cathode insertion host for Li-ion and Na-ion batteries (2023)
- In silico nanotoxicology (2023)
- Exotic magnetic and electronic properties of layered CrI3 single crystals under high pressure (2022)
- Pyrophosphate Na2CoP2O7 Polymorphs as Efficient Bifunctional Oxygen Electrocatalysts for Zinc-Air Batteries (2022)
- Spin and valence variation in cobalt doped barium strontium titanate ceramics (2022)
- Revealing the superlative electrochemical properties of o-B2N2 monolayer in Lithium/Sodium-ion batteries (2022)
- Strong Optical Excitation and High Thermoelectric Performance in 2D Holey-Phosphorene Monolayer (2022)
- Flexible 3D porous boron nitride interconnected network as a high-performance Li-and Na-ion battery electrodes (2022)
- Probing the electronic, optical and transport properties of halide double perovskites Rb2InSb(Cl,Br)6 for solar cells and thermoelectric applications (2022)
- First-principles calculations to investigate electronic structure and optical properties of 2D MgCl2 monolayer (2022)
- Bifunctional catalytic activity of 2D boron monochalcogenides BX (X = S, Se, Te) (2022)
- Asymmetry-Induced Redistribution in Sn(IV)-Ti(IV) Hetero-Bimetallic Alkoxide Precursors and Its Impact on Thin-Film Deposition by Metal-Organic Chemical Vapor Deposition (2022)
- Contact electrification through interfacial charge transfer (2022)
- Two-dimensional Nitrogenated Holey Graphene (C2N) monolayer based glucose sensor for diabetes mellitus (2022)
- Optoelectronic properties of 2D van der Waals heterostructure As/PtS2 by first-principles calculations (2022)
- Activation-Induced Surface Modulation of Biowaste-Derived Hierarchical Porous Carbon for Supercapacitors (2022)
- Two-Dimensional Perovskite/HfS2 van der Waals Heterostructure as an Absorber Material for Photovoltaic Applications (2022)
- Dimensionality effects in high-performance thermoelectric materials (2022)
- 2D Janus and non-Janus diamanes with an in-plane negative Poisson's ratio for energy applications (2022)
- Stability of and conduction in single-walled Si2BN nanotubes (2022)
- Computational identification of efficient 2D Aluminium chalcogenides monolayers for optoelectronics and photocatalysts applications (2021)
- Novel green phosphorene as a superior chemical gas sensing material (2021)
- Correlation between reduced dielectric loss and charge migration kinetics in NdFeO3-modified Ba0.7Sr0.3TiO3 ceramics (2021)
- High-Specific-Capacity and High-Performing Post-Lithium-Ion Battery Anode over 2D Black Arsenic Phosphorus (2021)
- Hydrogenation and oxidation enhances the thermoelectric performance of Si2BN monolayer (2021)
- Cobalt tetraphosphate as an efficient bifunctional electrocatalyst for hybrid sodium-air batteries (2021)
- Coexisting commensurate and incommensurate charge ordered phases in CoO (2021)
- Polypeptoid Material as an Anchoring Material for Li-S Batteries (2021)
- Theoretical Prediction of a Bi-Doped beta-Antimonene Monolayer as a Highly Efficient Photocatalyst for Oxygen Reduction and Overall Water Splitting (2021)
- Antimonene Allotropes alpha- and beta-Phases as Promising Anchoring Materials for Lithium-Sulfur Batteries (2021)
- Mechanism of formaldehyde and formic acid formation on (101)-TiO2@Cu-4 systems through CO2 hydrogenation (2021)
- Modulation of 2D GaS/BTe vdW heterostructure as an efficient HER catalyst under external electric field influence (2021)
- Harnessing the unique properties of MXenes for advanced rechargeable batteries (2021)
- Potential SiX (X = N, P, As, Sb, Bi) homo-bilayers for visible-light photocatalyst applications (2021)
- Catalyzing Bond-Dissociation in Graphene via Alkali-Iodide Molecules (2021)
- Temperature-Dependent Cationic Doping-Driven Phonon Dynamics Investigation in CdO Thin Films Using Raman Spectroscopy (2020)
- Orbital hybridization-induced band offset phenomena in NixCd1-xO thin films (2020)
- Room-temperature conversion of Cu2-xSe to CuAgSe nanoparticles to enhance the photocatalytic performance of their composites with TiO2 (2020)
- Molecules versus Nanoparticles (2020)
- Sensing of volatile organic compounds on two-dimensional nitrogenated holey graphene, graphdiyne, and their heterostructure (2020)
- Rational Design of 2D h-BAs Monolayer as Advanced Sulfur Host for High Energy Density Li-S Batteries (2020)
- Recent progress of defect chemistry on 2D materials for advanced battery anodes (2020)
- Enhancement of hydrogen storage capacity on co-functionalized GaS monolayer under external electric field (2020)
- Metal-functionalized 2D boron sulfide monolayer material enhancing hydrogen storage capacities (2020)
- Two-dimensional boron monochalcogenide monolayer for thermoelectric material (2020)
- Excitonic effects in the optoelectronic properties of graphene-like BC monolayer (2020)
- Bulk and monolayer As2S3 as promising thermoelectric material with high conversion performance (2020)
- High Thermoelectric Performance in Two-Dimensional Janus Monolayer Material WS-X (X = Se and Te) (2020)
- Highly Energetic and Stable Gadolinium/Bismuth Molybdate with a Fast Reactive Species, Redox Mechanism of Aqueous Electrolyte (2020)
- Highly Sensitive Gas Sensing Material for Environmentally Toxic Gases Based on Janus NbSeTe Monolayer (2020)
- Impact of edge structures on interfacial interactions and efficient visible-light photocatalytic activity of metal-semiconductor hybrid 2D materials (2020)
- Van der Waals induced molecular recognition of canonical DNA nucleobases on a 2D GaS monolayer (2020)
- Promising high-temperature thermoelectric response of bismuth oxybromide (2020)
- Optical excitations and thermoelectric properties of two-dimensional holey graphene (2020)
- Carbon-phosphide monolayer with high carrier mobility and perceptible I-V response for superior gas sensing (2020)
- Recent Advancements and Future Prospects in Ultrathin 2D Semiconductor-Based Photocatalysts for Water Splitting (2020)
- Sensing the polar molecules MH3 (M = N, P, or As) with a Janus NbTeSe monolayer (2020)
- Necklace-like Nitrogen-Doped Tubular Carbon 3D Frameworks for Electrochemical Energy Storage (2020)
- 2D g-C3N4 monolayer for amino acids sequencing (2020)
- Strain-Engineered Metal-Free h-B2O Monolayer as a Mechanocatalyst for Photocatalysis and Improved Hydrogen Evolution Reaction (2020)
- High temperature-mediated rocksalt to wurtzite phase transformation in cadmium oxide nanosheets and its theoretical evidence (2019)
- Efficient and selective sensing of nitrogen-containing gases by Si2BN nanosheets under pristine and pre-oxidized conditions (2019)
- Two-Dimensional CH3NH3PbI3 with High Efficiency and Superior Carrier Mobility (2019)
- The influence of edge structure on the optoelectronic properties of Si2BN quantum dot (2019)
- Spin-entropy induced thermopower and spin-blockade effect in CoO (2019)
- Enhanced Optoelectronic and Thermoelectric Properties by Intrinsic Structural Defects in Monolayer HfS2 (2019)
- Effect of electric field on optoelectronic properties of indiene monolayer for photoelectric nanodevices (2019)
- Emergence of Si2BN Monolayer as Efficient HER Catalyst under Co-functionalization Influence (2019)
- An emerging Janus MoSeTe material for potential applications in optoelectronic devices (2019)
Conferences
- 2D MgF2 nanosheet as a promising candidate for thermoelectric material (2021)
- Impact of stacking on the optoelectronic properties of 2D ZrS2/GaS heterostructure (2021)
- Electronic and optical properties of a structural defect in 2D MgF2 monolayer (2020)
- 2D Monolayer Boron Sulfide as an Efficient Material for Optical Nanodevices (2020)
- Revealing the Veil of the Stability of Monolayer Boron Sulfide Upon Air and Humidity Exposure (2020)
