Journal of Physics and Chemistry of Solids

Article	Citations
Editorial Board	188
Investigating the effect of Mo doping on structural and ferroelectric properties of BaTiO3 using electron microscopy	146
Editorial Board	141
Empowering spintronics performance of 3d transition metal adsorbed B4C3 monolayer: A DFT outlook	134
The carriers doping effect on electronic and optical behaviors of newly layered Sr1- xHfxFBiS2 alloying materials for light-modulator devices	118
Editorial Board	110
Preparation of phenyl-bridged hybrid organic-inorganic mesoporous vesicles with high thermal stability and hierarchical buildups	92
Cost-effective pure and Fe-doped amorphous and composite Ni–P alloys as efficient electrocatalysts for alkaline oxygen evolution reaction	91
Hydrothermally synthesized Ag decorated β-Ga2O3 heterostructures as low cost, reusable SERS substrates for the nanomolar detection of rhodamine 6G	89
First-principles investigations on the electronic structure, optical properties, and giant magnetic-optical Kerr effect in double-perovskite Ba2NiBO6 (B = Os, Ir)	88
Developing insights on physical properties of CsCuO3 for photocatalytic water splitting activity: A DFT perspective	86
Sodium lignosulfonate-modulated small-size BiOCl–C nanosheets with excellent visible light degradation of organic pollutant	86
n-type (Zr,Ti)NiSn half Heusler materials via mechanical alloying: Structure, Sb-doping and thermoelectric properties	84
Bandgap analysis of transition-metal dichalcogenide and oxide via machine learning approach	81
Elucidating the potential of nitrogen-containing heterocyclic core-based non-fullerene acceptors for organic photovoltaic applications	80
Biaxial strain enhanced electronic and photocatalytic properties of Y	79
Synergistic impact of metal/semiconductor (Co@Co3O4) core-shell nanostructures on the structure, electrical, and dielectric properties of BaTiO3-based composites	78
Length-dependent high-frequency response of aromatic and aliphatic molecules: predictions from first-principles calculations	77
Combining rhombohedral dodecahedral ZnO with g-C3N4 nanosheets for enhanced photocatalytic activity	74
Oxygen vacanciesWriting – introduced to iron oxide by melamine assist to improve lithium storage performance	74
Dendrite like nanorod bundles of cobalt phosphate electrodes for efficient water splitting and energy storage applications	74
Conductive polypyrrole-promoted Li3V2(PO4)3 nanocomposite for rechargeable lithium energy storage	73
Preparation, antioxidant activity, and theoretical studies on the relationship between antioxidant and electronic properties of bis(thio/carbohydrazone) derivatives	72
Alkali metal doping in B–C3N4 extends carrier lifetime and increases the CO2 adsorption: DFT study and time-domain Ab initio analysis	71
Exploring the feasibility of sodium alginate as a binder in aqueous zinc-ion batteries incorporating α-MnO2 nanorod cathodes	71

Functional properties of single crystals and optical ceramics based on AgCl – AgI and AgCl – AgBr0.7I0.3 as isothermal sections of the AgCl – AgBr – AgI system	71
Synthesis of MnOx catalysts via sucrose reduction deposition technique for efficient low-temperature NH3-SCR	71
Improved electrochromic performance of nickel oxide porous films by regulating their semiconductor type by titanium doping	70
Computational strain engineering and Hubbard's effect investigation on Li2CuWX6 (X = Cl, Br) double perovskites: A promising Route to spintronic Innovation	69
Corrigendum to “Magnetic composites obtained by H2 treatment of (Mg,Ni)3Si2O5(OH)4 phyllosilicate nanoscrolls” [J. Phys. Chem. Solids 209 113229]	68
The upgraded performance of the NiFe2O4 /C electrocatalyst using Co substitution for the oxygen reduction reaction in an alkaline solution	66
The mechanism of hydrogen generation from H2O splitting of Ben (n = 14–17) clusters based on density functional theory	66
Enhanced electrochemical performance of Li4Ti5O12 anode material by LaF3 surface modification for lithium-ion batteries	65
Enhanced hole accumulation and visible-light harvesting in Mn-doped BiVO4 via d-d transition-Mediated charge transfer	64
Unveiling the metal–insulator-transition in NaIrO	63
Advancing green energy: Sustainable power generation via NBT-based sodium-substituted ferrite nanocomposites	62
α-Mn2O3 porous fibers synthesized by air-heated solution blow spinning (A-HSBS) technique: electrochemical assessment for oxygen evolution reaction in alkaline medium	61
Neodymium-substituted nanostructured SrTiO3 nanoparticles with varying molar concentrations for optoelectronic device applications	61
Enhancement of the microwave absorption performance of flaky FeSiCr powder through the compounding of cobalt ferrite	61
Synergic effect of CuS and MgO for boosting adsorption-photocatalytic activity of S-doped biochar	61
Preparation of Fe3O4/ZIF-9 as an efficient heterogeneous nanocatalyst for brilliant green dye removal via advanced oxidation processes	59
Phosphorus doped-mesoporous TiO2 as an efficient electron transport layer for high-efficiency and stable perovskite solar cells	58
Improving hydrogen storage characteristics of Mg–Ni-based alloys by adding Y and melt spinning	57
Mechanical, optical and thermoelectric properties of Janus BiTeCl monolayer	57
High hydrogen production in two-dimensional GaTe/ZnI2 type-II heterostructure for water splitting	57
Investigations and optimizations of lead-free	55
Unusual mechanical properties of CO2–V: Auxetic potential in a high-pressure polymorph of carbon dioxide	54
Molten Na reduced T-Nb2O5 nanorods enable enhanced Na-storage performance	54
A comprehensive review of the WO3 and its composites for the removal of priority pollutant: Chlorophenols in wastewater treatment	54
First-principles investigation of electronic and optical properties in ternary silver-based halides MlAgmXn	53
Investigation of the electronic properties of a topological semimetal LaAuPb under uniaxial strain and hydrostatic pressure: A DFT approach	53
SCAPS-1D study on the design and performance optimization of Sr3NCl3 solar cell: Assessing the significance of copper oxide (Cu2O) and copper(I) thiocyanate (CuSCN) as hole transport layers	52
X-ray induced synthesis of beta tin (β-Sn)	51
Crystal growth by chemical vapor transport method and photoelectric properties of SnS, Sn2S3, SnS2	51
Mono- and bimetallic oxides as photo-electrocatalysts for the oxygen evolution reaction – A review	51
Investigating the impact of various electron transport layers on the performance of Sn-based perovskite solar cells: A device simulation using SCAPS-1D	51
Synergistic effect of nitrogen and oxygen self-doping in bio-waste derived activated carbon for supercapacitor applications	50
MOF-derived NiS2/V2O3 spherical heterostructures for high-performance supercapacitors	49
Thin thickness electromagnetic wave absorbent: Fe3O4 decorated carbon nanofibers composite with designable 3D hierarchical architecture	49
Highly stable Zirconium@metal-organic framework (UiO-66)-based lamellar membranes for organic solvent nanofiltration	49
Enhanced structural and optical properties of Cs0.1FA0.9PbI3 perovskite thin film with potassium doping for perovskite solar cells	49
Design and exploration of phenazine based new organic dyes as organic photovoltaic material	49
A theoretical study of all-inorganic perovskite solar cells: Computational modeling of the CsPbI	48
Investigations of photoelectrochemical performance of polycrystalline Bi-doped ZnO thin films	48
Electronic structure and quantum capacitance analysis of transition metal doped cobalt diselenide for supercapacitors	47
A visible light responsive Bi2S3/MIL-53(Fe) heterojunction with enhanced photocatalytic activity for degradation of tetracycline	46
Exploring new lead-free halide perovskites RbSnM3 (M = I, Br, Cl) and achieving power conversion efficiency > 32 %	46
Boosting hydrogen evolution with MoS2/Ti3C2Tx MXene-modified CdS: A Synergistic Approach to Visible-light Photocatalytic Water Splitting	46
Fenton-like degradation of methyl orange over CeO2 loaded on porous Al2O3: Catalyst preparation, efficiency and mechanism	45
Editorial Board	44
Single-crystal LiCsMo3O10: Growth, low-temperature thermodynamics and luminescence	44
Engineering high performance LiNi0·8Co0·1Mn0·1O2 cathodes through controlling fabrication methods	44
Construction of novel hybrid Z-scheme Agx/WO3@CdS decorated g-C3N4 heterojunction as composite photocatalyst for efficient degradation of organic dyes	44
Energy transfer between two luminous centers and tunable emission of La7Nb3W4O30:Dy3+, Eu3+	44
Sulfurization temperature dependent supercapacitive performance of NiS electrode: An advanced method to boost nanostructures on nickel foam	44

Amorphous UiO-66-NH2 for next-generation interface engineering in perovskite solar cells	44
A comparative study of CO oxidation on Cu-doped C3N monolayer with N and C vacancies	43
Study of electronic and transport properties of some topological semimetals XPtBi(X=Gd,Nd,Y) compounds	43
In-situ electron loss spectroscopy reveals surface dehydrogenation of hydrated ceria nanoparticles at elevated temperatures	43
Effect of impurity phase and high-pressure synthesis on the superconducting properties of CaKFe4As4	43
Theoretical insights into donor–acceptor energetic alignment, photovoltaic performance, and systematic acceptor matching of D–A–D donors with fullerene and perylene diimide derivatives	43
First-principles calculation of cresol contaminants removal from wastewater environment	42
Ni/CeZr deposition on metallic mesh supports for CO2 methanation. Adherence and morphology	41
One-step solution combustion synthesis of Bi/BiOCl nanosheets: Reaction mechanism and photocatalytic RhB degradation	41
Recent trends on van der Waals heterostructures for photocatalytic applications	41
Theoretical investigation of transition metal (Cr, Fe)-Doped AlN in a rocksalt structure: A DFT study on physical properties	41
Ultrafast terahertz insight into photovoltaic performance of nanocrystalline hyperdoped silicon	41
Thermally activated flux flow of vortex liquid and suppression of vortex glass in Ca10(Pt4As8)(Fe2As2)5	40
Probing hydrogen storage through cation replacement in CaNiH3 for clean environment: A computational explaination	40
Plasma synthesized molybdenum derived nano-fiber films: The influence of surface composition on their SERS effect	40
Preparation of polymeric carbon nitride/TiO2 heterostructure with NH4Cl as template: Structural and photocatalytic studies	40
Designing highly efficient electrocatalyst for ORR and OER of transition metals doped g-C9N7: A density functional theory study	40
Pioneering ginger juice extract mediated synthesis of magnesium indate nanoparticles	40
DFT and experimental study of Mg substituted strontium oxide for optoelectronic applications	40
Designing a promising electrocatalysts based on iron single-atom doped in graphyne-like BN-yne for water splitting application	39
Efficient removal of antibiotic linezolid over Pd nanoparticles/polypyrrole-carbon black/Bi2S3 visible light photocatalyst	39
Theoretical and experimental study of the mechanism for preparation of SiC nanowires by carbothermal reduction	39
Synthesis and dye adsorption studies of WO3/MoO3 nanocomposites	39
Reinforce effect with carbon interphase for high performance multi-phase V-based anode on sodium ion batteries	38
Doping of n-type Bi2Se3 single crystal with Fe, Ru, Os, and Mo	38
Glucose electrooxidation modelling studies on carbon nanotube supported Pd catalyst with response surface methodology and density functional theory	38
Influence of subphase parameters and spreading conditions on interfacial aggregation behaviour of a new amphiphilic dimeric mesogen	38
Role of Fe atom valence states and oxygen vacancies in substituted lanthanum ferrite La0.67Sr0.33FeO3-γ	37
Synthesis of porous Mg2MnO4 spinel microspheres and enhanced lithium storage properties	37
Enhancing pseudocapacitive energy storage system performance with electrodeposited CuSx and CoSx biphasic transitional metal sulfide (TMS) based nanostructured electrode on nickel foam	37
Preparation of magnetic CuO/Fe3O4/ZnO photocatalyst for complete degradation of methylene blue under natural sunlight irradiation	37
Computational study of half-metallic behavior, optoelectronic and thermoelectric properties of new XAlN3 (X = K, Rb, Cs) perovskite materials	37
Silicon atom intercalation: Electronic structure reconstruction and regulation mechanism of silicene nanoribbons	37
Gapped edge states and quantum valley Hall effect in a planar honeycomb monolayer of group III–V binary compounds of the form BX (X = N, P, and As)	37
Raman and first-principles study of the pressure-induced Mott-insulator to metal transition in bulk FePS3	37
Tailoring optical and dielectric properties of TiO2 through mono- and co-doping with Ag and Sr	37
Synergic functionalization of graphitic carbon nitride with copper ferrite for superior uptake performance of methylene blue dye	37
First-principles study of La and Mg doped/co-doped TiO2 for tailoring trap states in the electron transport layer of perovskite solar cells	37
High-density defect-induced ultrahigh boron and nitrogen doping of iron–copper-functionalized porous carbon nanosheets for enhanced water splitting	36
Efficient photocatalytic degradation of ciprofloxacin by doped Bi4O5I2 with Gd3+ as an electron trap: Gd3+ substitutes Bi3+ in the lattice	36
Magnetization process of concave Fe3O4 nanoparticles	36
Sodium titano phosphate: An efficient ion exchanger for the sequestration of Cs	36
Defective TiO2 synthesized by flame spray pyrolysis for photocatalytic removal of single and mixed methylene blue and Cr (VI) pollutants under low-LED light	36
Water sorption on pyrochlore – Niobium hydration and calcium susceptibility to leaching unraveled by DFT simulations	36
Crystal-to-glass transition during mechanical milling of Li phosphates: structural, thermal and Li-ion mobility behaviors in LiCa(PO3)3	35
Development and enhancement of charge separation processes for the degradation of RhB using an innovative ZnO/MgIn2S4 S-scheme heterojunction photocatalyst	35
Synthesis of PVA fiber/CoFe2O4/Cu composite and evaluation of its electromagnetic wave shielding performance	35
Oxygen addition effect on RF sputter fabricated amorphous IGZO thin films investigated in-situ using photoelectron spectroscopy	35
Hydrothermal preparation of flower-like Ni2+ doped Bi2WO6 for enhanced photocatalytic degradation	35
Simple, cheap and fast way to produce mixed valence vanadium oxide/PEDOT composite for cathode material of Li-ion batteries with enhanced stability	35
Exploring the electrical behavior of iodine substituted CaCu3Ti4O12-xIx by impedance and modulus spectroscopy	34
Preparation of Ti4O7/PrFeO3 and performance of three-dimensional photoelectrocatalytic degradation of yellow medicine wastewater	34
Investigation of cubic K2NaXBr6(X=Sc, Y) double perovskites for optical and thermoelectric devices	34
Floret assembly of NiCo2O4@Tailored nanostructured carbon support for oxygen evolution reaction in alkaline medium	34
The prediction of hydrogen storage capacity and solar water splitting applications of Rb2AlXH6 (X= In, Tl) perovskite halides: A DFT study	34
Ab-inito simulation of the structural, electronic and optical properties for the vacancy-ordered double perovskites ATiI (A = Cs or NH); a time-dependent density functional theory study	34
The invisible hand of pre-adsorbates: Unveiling oxygen's role in sculpting Cu–TiN interfaces	33
Structural, electronic and mechanical properties of a novel graphenylene-like structure based on GeC	33
Simulation and analysis of different TMDC solar cells under proton radiation using Monte Carlo methods, SCAPS, and machine learning techniques	33
Microstructure evaluation and thermal properties of Ag–Sb alloys	33
DFT study of the crystal structure, elastic and electronic properties of the phases: Ti2InC(1-x)Nx superconductor	33
Developing 3D ion diffusion mechanism in LixTiS2 cathode for lithium solid-state battery	33
Structure, magnetism and large anomalous Hall effect of hexagonal MnYSn (Y = Ti, Mn and Fe) ribbons	32
Structural, optical and magnetic properties of Fe3O4-rGO nanocomposite for removal of four organic dyes from aqueous solutions	32
Recyclable CuO@CSs as highly efficient peroxymonosulfate activator for Rhodamine B degradation	32
Development of Mn-doped Y3Al5O12 single crystal scintillators	32
Silicon, carbon, boron nitride nanocages and their halogen doped derivatives as anodes in metal-ion battery	31
Bimetallic systems of ZnO/Al/Ag applied on cell PEC and photocatalytic system	31
Editorial Board	31
Unveiling the recently synthesis noncentrosymmetric layered ASb3X2O12 (A = K, Rb, Cs, Tl; X = Se, Te) via first principles calculations	31
Non-centrosymmetric Y3FeGaSe7 and Y3Mn0·5SiSe7 with extremely low thermal conductivities	31
Sulfhydryl and amino group simultaneously functionalized silica for selective removal of Hg(II) from water under neutral conditions and its application by packing into the column	31
Judd-Ofelt analysis of Eu3+ and adjustable emission in Eu3+/Eu2+ co-doped sodium aluminosilicate glasses	30
Synthesis of ultrathin, nano-sized Ti3C2Tx with abundant =O and –OH terminals and high transparency as a cocatalyst: Enabling design of high-performance Titania-Ti3C2Tx hybrid photocatalysts	30
Design and construction of MoS2/Ni3S2 nanosheets decorated on multi-walled carbon nanotubes as a sustainable counter electrode for dye-sensitized solar cells: An experimental and computational investi	30
An aqueous solution of fluorescent MoS2 quantum dots toward a sensitive and selective probe for Fe3+: A tri-mode spectroscopic sensing technique	30
First-principles calculations of fluorine-doped Li-rich Mn-based Li1.25Mn0.417Ni0.167Co0.167O2 cathode for Li-ion batteries	30
Enhanced photoresponse in graphene/Al doped ZnO nanorod junction	30
Gold supported on graphene oxide/silica photocatalyst for hydrogen generation from formic acid	30
Tunable Schottky barriers in TaTe2	30

Enhancing electrochemical properties of LiCoO2 using naturally reduced nano Co3O4 for high-voltage lithium-ion batteries	30
Editorial Board	30
Study of spin control on half metallic ferromagnetism and thermoelectric properties of MgEu2(S/Se)4 for spintronic and energy harvesting devices	30
Orbital overlap energy explains phase diagrams of transition metal compounds	30
Performance of cobalt doped two dimensional black phosphorus (Co-2D BP) for bifunctional hydrolysis in alkaline solution	29
Frist principle study of double perovskites Cs2AgSbX6 (X = Cl, Br, I) for solar cell and renewable energy applications	29
Lattice dynamics and Raman spectrum of supertetragonal PbVO3	29
Fabrication, phytotoxicity, and electrochemical performance of rare-earth metal-based mixed La–Ce cobaltite nanospheres: Applications in energy storage and environmental remediation	29
Size engineering of porous CuWO4–CuO heterojunction for enhanced hydrogen evolution in alkaline media	29
Optimizing thermoelectric properties of CoTiP half-Heusler via doping with Br-, Se- and Ge atoms using first principle study	29
Confinement of quasi-atomic structures in Ti	29
Improved photoactivity of TiO2 photoanode of dye-sensitized solar cells by sulfur doping	29
Facile composite engineering to boost thermoelectric power conversion in ZnSb device	29
Numerical modeling and performance evaluation of non-toxic Cs2TiF6 based perovskite solar cells: A SCAPS-1D simulation study	29
Modulating phonon-electron Fano resonance in Si nanoparticles through laser exposure and properties of surrounding nanoparticles	29
Pb-free Sn-based bilayer perovskite heterojunctions enabling high-efficient tandem photovoltaics	29
Controlling surface reconstruction of SrTiO3(100) with adhesive outgassing	29
First-principles studies on the oxygen vacancy formation in α-Na2FePO4F and β-Na2FePO4F	29
Effects of coupling ability of dopants on NbO6 vibration and piezoelectric properties of KNN lead-free ceramics	29
Cu2O hole transport layer optimization for Sb2(S,Se)3 solar cells: combining machine learning prediction with experimental validation	29
Mechanistic investigation of pH responsive delivery of isoniazid and pyrazinamide using C6N6 based on density functional theory and molecular dynamics	29
The prospect of CuX (X=O, S, Se) co-catalysts in photocatalysis: From engineering heterostructural integrity towards enhanced photocatalytic activities – A concise review	28
Half-metallic ferromagnetism and thermoelectric effect in spinel chalcogenides SrX2S4 (X = Mn, Fe, Co) for spintronics and energy harvesting	28
Polyaniline/g-C3N4 hybrid nanoparticles: Fabrication, characterization and boosting bisphenol destruction and hydrogen gas evolution through direct S-scheme aspects	28
Computational study of the structural, optoelectronic, magnetic, and thermoelectric properties of novel EuMg2C2 (C=P and As) zintl compounds	28
Synthesis of CdS–SnS photocatalyst by chemical co-precipitation for photocatalytic degradation of methylene blue and rhodamine B under irradiation by visible light	28
ZnFe2O4@l-Arginine-Ni: A novel, green, recyclable, and highly versatile catalyst for the synthesis of 1H-tetrazoles and oxidation of sulfides to the sulfoxides	28
Pressure and temperature dependence of the electric modulus and loss factor of Poly(vinyl alcohol)/Poly(vinylidene fluoride) blends reinforced with Nano - Graphene platelets	28
Effect of Eu2O3@C composite catalyst on hydrogen storage performance of Mg96La3Ni alloy	28
OLi	28
One step electrodeposition to prepare Mg-doped zinc anodes for lithium-ion batteries	28
Fabrication of nitrogen-doped laser-induced graphene-based electrodes: evaluation of electrochemical energy storage performance of symmetric supercapacitor devices	28
Photocatalytic degradation of Rhodamine B dye over oxygen-rich bismuth oxychloride Bi24O31Cl10 photocatalyst under UV and Visible light irradiation: Pathways and mechanism	28
Enhanced electrochemical hydrogen storage performance of Co9S8 material by doping with cobalt nanoparticles embedded hollow porous carbon nanofibers	27
Niobium based ferromagnetic half metals NbMnZ (Z=As, Sb and Bi) for thermoelectric and spintronics applications-materials computations	27
Dissolution dynamics of NaCl at the atomic scale	27
Editorial Board	27
Facile design of PANI/G-CN/WO3 nanocomposites with integrated photocatalytic and dielectric functionalities	27
Bimetal Mo–Ni/NC as an effective electrocatalyst with accelerated kinetics for the oxygen evolution reaction	27
Deep insights into the sodium transport mechanism and phase evolution in Na4VP2O9 cathode/anode material	27
Thermodynamic and dynamic stability of NaLiC4	27
Designing efficient energy materials: Optoelectronic and thermoelectric perspectives of X2YBiCl6 (X = Cs, Na; Y = Ag, Au) double perovskites	27
Effect of Sr doping on electronic transport properties of SnS2 hexagonal nanoplates	27
Enhanced activity of hydrothermal prepared Nd/Pr-codoped Bi2WO6 microspheres in photodegradation of Rhodamine B	27
Revolutionizing light energy: Unleashing the energy and storage potential of Nd2S3:LaS2@In:SnO2 photoactive electrode	26
Fabrication of cubic sodium zirconium phosphate nanomaterials with high-efficiency silver ion uptake for antibacterial applications	26
A small fraction of defects can order a crystal	26
Optimization of catalyst loading on nickel foam substrates for monoclinic NaBiO2 towards OER applications	26
Editorial Board	26
Hydrolytic properties of hydrogenated Mg–Li-Gd-Zn-Zr alloys	26
Investigation of the potential solar cell application of Cs2AgBiBr6 lead-free double perovskite	26
Magnetic nanoreactor Fe3O4@HNTs as heterogeneous Fenton-like catalyst for acid fuchsin degradation: Efficiency, kinetics and mechanism	26
Dinuclear lanthanide complexes with excellent photophysical behaviour in solid-state and hybrid thin-film	26
Influence of doping and electric field on magnetism of NiBr2 monolayer: Possible potentiality for multiferroicity and thermoelectricity	26
Novel strategy for efficient conversion of biomass into N-doped graphitized carbon nanosheets as high-performance electrode material for supercapacitor	26
Effect of nickel ion concentration on structural, optical and electrical properties towards Ni–H3BTC-MOF formation for nonlinear saturable absorption phenomenon	26
Spectroscopic visualization of intermediate phases during CVD synthesis of MoS2	26
Charge transport mechanism in boron-irradiated Si3N4	26
Effect of pyrolysis temperature on carbon materials derived from reed residue waste biomass for use in supercapacitor electrodes	26
Modeling and analysis of an environmentally friendly CuBi2O4 solar cell with advanced n/p/p+ architecture	26
Improving photocatalytic efficiency: Harnessing the importance of Ag@HfO2 core-shell nanostructures	26
Stability, electronic and magnetic properties of boronphosphide (BP) graphenylene induced by interstitial atomic doping	26
Noise induced dynamics of two-qubit entangled Bell’s states	25
Impact of Coulomb interactions on the phase transition and electronic structure of Ba<	25
Tailoring nickel disulfide for energy applications: A hydrothermal approach to enhanced performance	25
Tuning hydrogen evolution reaction activity via isomeric design of B28-based single-atom catalysts	25
Room temperature ferromagnetism and thermoelectric behavior of calcium based spinel chalcogenides CaZ2S4 (Z = Ti, V, Cr, Fe) for spintronic applications	25
Electronic structure properties of boron–doped and carbon–boron–codoped TiO2(B) for photocatalytic applications	25
Unlocking the potential of ZnO nanorods: Structural insights for enhanced photocatalytic activity	25
Modification of silicate structural units by K2	25
Improving cycling performance and high rate capability of LiNi0.5Mn0.3Co0.2O2 cathode materials by sol-gel combustion synthesis	25
Prediction of Raman signatures, electronic structure, and ion transport mechanisms in Nb2C and Nb2CO2 MXenes for Li/Na-ion batteries: An Ab Initio study	25
Tunable electronic and optical properties of GeC/g-C3N4 vdWH by electric field and biaxial strain	25
Phase transitions and ferroelectricity of perovskite layered Sr2Nb2O7 ceramics	25
A first-principles study of the MoSeS/Hf2CO2 heterojunction for enhanced photocatalytic water splitting	25
Integration of SCAPS-1D and density functional theory for the performance evaluation of RbGeI3-based perovskite solar cell	24
Designing and simulating of new highly efficient ultra-thin CIGS solar cell device structure: Plan to minimize cost per watt price	24
Interfacial modification of BiVO4 photocatalyst: Construction of heterojunction with AgI	24
Plasmonic enhanced branched Ag sensitized Cu2O–CuO/TiO2 heterojunction with unprecedented photocatalytic degradation under visible light	24
DFT studies of the effect of magnetic ordering and Hubbard U on the properties of UN	24
Role of anion substitution in modulating the multifunctional properties of RbTaO3 perovskites; A DFT approach	24
The thermoelectric properties of the two-dimensional Nowotny-Juza material NaBeX (X = P, As, and Sb)	24
One-pot preparation of a novel CoWO4/ZnWO4 p-n heterojunction photocatalyst for enhanced photocatalytic activity under visible light irradiation	24
Highly efficient Z-scheme photocatalysts of Ag/AgIn5S8 decoration on surfaces with high exposure (040) BiVO4 for enhanced photocatalytic performance	24
Regulation of structural and terahertz properties of TiC nanoparticles by carbon-coating and nitrogen-doping	24
Bilayer graphene, bilayer GeC and graphene/GeC bilayer heterostructure as anode materials for lithium-ion batteries: First-principles calculations	24
Glutaraldehyde-Glyoxal Co-crosslinked Gelatin Hydrogel Electrolytes with KI/HQ Dopant for Solid-State Electric Double Layer Capacitors	24
Ag nanoparticles incorporated metal organic framework (Ag@ZnBDC): Highly sensitive and selective detection of Hg2+ ions	24
Highly efficient lead-free ethyl ammonium substituted perovskite solar cell simulated using SCAPS 1D	24
Multifunctionality of AlBaFe12O19 /CoZnFe2O4 hybrid nanocomposite: Promising structural, elastic, morphological, compositional, optical, and magnetic properties	24
Replacement of interlayer anion via memory effect of layered double hydroxide: A promising strategy for fabricating nanostructures with better flame-retardant performance	24
Tunable electronic and optical properties of h-BP/MoS2 van der Waals heterostructures toward optoelectronic applications	24
Highly selective catalytic transfer hydrogenation of biomass derived furfural to furfural alcohol over Zr/SBA-15 catalysts	23
Development of novel TiN–LiAlSiO4/SnS/AuPd multilayer films for H2 generation by photocatalysis	23
Spin-orbit coupling driven A2WCl6 perovskites: DFT exploration of electronic, optical, and photocatalytic potential for H2 generation and CO2 conversion	23