Constant Energy Research Articles

An Interspecific Assessment of Bergmann's Rule in Tenebrionid Beetles (Coleoptera, Tenebrionidae) along an Elevation Gradient.

In endotherms, body size tends to increase with elevation and latitude (i.e., with decreasing temperatures) (Bergmann's rule). These patterns are explained in terms of heat balance since larger animals need to produce less heat relative to their size to maintain stable body temperatures. In ectotherms like most insects, where this mechanism cannot operate, a reverse pattern is frequently observed, as a higher surface area-to-volume ratio in colder climates may allow for more rapid heating and cooling. However, patterns of increasing body size with decreasing temperatures can also be observed in ectotherms if selection for more stable internal temperatures leads to smaller surface area-to-volume ratios. Data on tenebrionids from Latium (Central Italy) were used to model elevational variations in average values of body size (total length, mass and volume) and surface area-to-volume ratio. Analyses were performed by considering the whole fauna and two ecological groups separately: ground-dwelling species (geophilous) and arboreal (xylophilous) species. The surface area-to-volume ratios declined with increasing elevation in all cases, indicating that the need for heat conservation is more important than rapid heating and cooling. However, in xylophilous species (which typically live under bark), body size increased with increasing elevation, and in geophilous species, an opposite pattern was observed up to about 1000 m, followed by an increasing pattern. This suggests that a reduction in resource availability with elevation limits body size in geophilous species up to a certain elevation but not in xylophilopus species, which benefit from more climatically stable conditions and constant resources and need energy for overwintering.

Three Diterpene Lactones from Andrographis paniculata (Burm. f) Nees In vitro, In silico Assessment of the Anticancer and Novel Liposomal Encapsulation Efficiency

: Three compounds from Andrographis paniculata (Burm. f) Nees leaf were isolated and identified using 1H, 13C, 2D-NMR, and HR-MS techniques for the first time. Compound 3,19-Di-O-acetylandrographolide (3,19-DAA) or (4) is produced by acetylating compound (2). Compounds (2) and (4) have been investigated for their cytotoxic effects on three human cancer cell lines (SK-LU-1, Hela, and HepG2) using the MTT method. Compound (4) demonstrated significant cytotoxicity against all three cancer cell lines, with IC50 values ranging from 8.38 to 10.15 μM. This represents an increase in cytotoxicity of 2.67 to 3.12-fold compared to compound (2). One way to deal with the problem of low water solubility is by encapsulating (4) into liposomes using a thin-film hydration technique. The optimal conditions for maximizing encapsulation efficiency involve molar ratios of phosphatidylcholine, 3,19-DAA, and cholesterol at 4:1:1. Encapsulating compound (4) within nanoscale liposomes increases its water solubility compared to the free form of compound (4). Pose 324 of compound (4) demonstrated the best conformation among 500 docking conformations when docked to enzyme 1T8I in a in silico docking study. The free Gibbs energy and inhibition constant were determined to be -7.09 Kcal/mol and 6.32 μM, respectively. These values help elucidate the strong interaction between compound (4) and the enzyme in the ligand interaction model. The molecular dynamics simulation using Desmond software in the Linux environment was conducted for a duration of 0 to 100 nanoseconds on the complex formed by pose 324 and 1T8I. The results showed effective interactions within the complex, with stability observed from 0 to 60 nanoseconds. Throughout the simulation, specific amino acids such as Ala 499 (involved in 90% of the simulation time with hydrogen bonding via a water bridge) and Thr 501 (involved in 50% of the simulation time with one hydrogen bond via a water bridge) were found to play significant roles. The majority of torsion bondings are C-O bondings in the acetyl group of compound (4), with torsion energy values of 13.47 Kcal/mol. Carbon atom C-29 at position 324 exhibits the highest fluctuation.

Inertial range of magnetorotational turbulence.

Accretion disks around compact stars are formed due to turbulence driven by magnetorotational instability. Despite over 30 years of numerous computational studies on magnetorotational turbulence, the properties of fluctuations in the inertial range-where cross-scale energy transfer dominates over energy injection-have remained elusive, primarily due to insufficient numerical resolution. Here, we report the highest-resolution simulation of magnetorotational turbulence ever conducted. Our simulations reveal a constant cross-scale energy flux, a hallmark of the inertial range. We found that as the cascade proceeds to smaller scales in the inertial range, the kinetic and magnetic energies tend toward equipartitioning with the same spectral slope, and slow magnetosonic fluctuations dominate over Alfvénic fluctuations, having twice the energy. These findings align remarkably with the theoretical expectations from the reduced magnetohydrodynamic model, which assumes a near-azimuthal mean magnetic field. Our results provide important implications for interpreting the radio observations by the Event Horizon Telescope.

Tritium β decay and proton-proton fusion in pionless effective field theory

The Gamow-Teller and Fermi matrix elements, 〈GT〉 and 〈F〉, respectively, for tritium β decay are calculated to next-to-leading order (NLO) in pionless effective field theory in the absence of Coulomb interactions and isospin violation giving the leading order predictions 〈GT〉0=0.9807 and 〈F〉0=1. Using an experimentally determined value for the tritium β decay GT matrix element, the two-body axial current low energy constant is fixed at NLO yielding L1,A=6.01±2.08fm3 at the renormalization scale of the physical pion mass, which agrees with predictions based on naive dimensional analysis. The impact of L1,A on proton-proton fusion is also discussed. Finally, the consequences of Wigner-SU(4) spin-isospin symmetry are considered for the Gamow-Teller matrix element. Published by the American Physical Society 2024

Thermal Relaxation in Janus Transition Metal Dichalcogenide Bilayers.

In this work, we employ molecular dynamics simulations with semi-empirical interatomic potentials to explore heat dissipation in Janus transition metal dichalcogenides (JTMDs). The middle atomic layer is composed of either molybdenum (Mo) or tungsten (W) atoms, and the top and bottom atomic layers consist of sulfur (S) and selenium (Se) atoms, respectively. Various nanomaterials have been investigated, including both pristine JTMDs and nanostructures incorporating inner triangular regions with a composition distinct from the outer bulk material. At the beginning of our simulations, a temperature gradient across the system is imposed by heating the central region to a high temperature while the surrounding area remains at room temperature. Once a steady state is reached, characterized by a constant energy flux, the temperature control in the central region is switched off. The heat attenuation is investigated by monitoring the characteristic relaxation time (τav) of the local temperature at the central region toward thermal equilibrium. We find that SMoSe JTMDs exhibit thermal attenuation similar to conventional TMDs (τav~10-15 ps). On the contrary, SWSe JTMDs feature relaxation times up to two times as high (τav~14-28 ps). Forming triangular lateral heterostructures in their surfaces leads to a significant slowdown in heat attenuation by up to about an order of magnitude (τav~100 ps).

Study of promising lithium-based lead-free double perovskites Li2AuBiX6 (X = Cl, Br, and I) for optoelectronic and other renewable energy applications

The current study effort primarily focuses on the computational investigation of the physical properties of Li2AuBiX6 (X = Cl, Br, and I) double perovskites (DPs) utilizing the Density Functional Theory (DFT) framework. The structural and elastic characteristics have been evaluated to reveal phase and mechanical stability. The assessed formation energy and elasticity constants calculations validate that the examined DPs possess cubic phase, exhibit stability, and demonstrate ductility. The band structure analysis has been accomplished with a modified Becke-Johnson (mBJ) potential. Theband structure simulations reveal that Li2AuBiCl6, Li2AuBiBr6, and Li2AuBiI6 possess an indirect energy gap, with values of 1.12 eV, 0.77 eV, and 0.084 eV, respectively. We further examined the optical parameters in the spectrum of incoming photons from 0 to 4 eV. Considerable absorbance in the visible spectrum has been observed for Li2AuBiX6 (X = Cl, Br, and I), suggesting that these DPs are compatible with photovoltaics. Finally, we have computed thermoelectric (TE) characteristics in relation to temperatures within the range of 100 to 600 K. The investigated DPs might be suitable for thermoelectric systems, as indicated by the moderate values of the figure of merit, which needs to be improved. The obtained absorption and figure of merit values surpass similar perovskites Rb2AuBiX6. Hence, the current work might be advantageous for developing novel photovoltaic and TE systems.

Effect of Phytic Acid, Tin Oxide and Graphite Incorporation in Polyaniline Semiconductive Ink

Enhanced electrical conductivity and pressure sensing functionalities of phytic acid-doped polyaniline ink (PPhyA) incorporated with SnO2 (PPhyAS) and graphite flakes (PPhyAG) as reported in our previous article, encouraged us to explore the electrical conduction mechanism and associated optical properties. In order to realize the enhanced electrical conduction in the reported inks, detailed studies were carried out in our research described here in comparison with normal HCl-doped polyaniline (PANI). This can be attributed to the formation of a highly ordered molecular arrangement with high crystallinity, a change in the hopping pathway between two adjacent molecules and the hopping activation energy of the PANI chain in the phytic acid-doped ink systems. Optical parameters, such as absorption edge, Urbach energy, refractive index, extinction coefficient, optical conductivity and optical dielectric constants, were estimated from the result of UV-Vis spectroscopy. The results of these studies showed enhancement of the optical properties of the phytic acid-doped ink systems (PPhyA, PPhyAS and PPhyAG) in the low photon energy range as compared to HCl-doped PANI. Phytic acid-doped ink systems are paintable on a variety of flexible surfaces, such as paper and plastics. Hence, we suggest that the phytic acid-doped ink systems have a great potential for developing flexible and foldable circuitry for infrared optics and remote sensing.

Experimental investigation of nanosecond pulsed laser ablation of polycrystalline diamond composite

A fundamental understanding of the laser ablation of polycrystalline diamond composite (PCD) at different laser energy intensities is indispensable for extending these findings to practical applications where, through appropriate parameter combinations, a substantial amount of material with minimal thermal damage should be removed. The objective of this study is to investigate experimentally the nanosecond ablation of polycrystalline diamond composite at different laser pulse energies and input energy densities. The research comprised two distinct categories of experiments: (1) single-point and (2) line experiments. In single-point tests, the number of the incidence pulses (N.P) was varied from 1 to 100 pulses with different pulse energies (Ep) ranging from 40 to 200 µJ. As the N.Ps increased, the ablation depth increased as well. No considerable enhancement in ablation depth was observed with the increase in pulse energies. For the line experiments, the results emphasized the differences in ablation depths by nearly a factor of 2, resulting in a corresponding change in laser input densities from 6.5 J/mm2 to 1.3 J/mm2. The ablation difference was pronounced as the number of repeats of the scanning path increased. The results emphasize that the ablation depth varies at the same pulse energy when the pulse overlap decreased from 100 % to lower percentages. Based on these results, a constant laser energy density with three different combinations of laser inputs—namely, scanning speed and average power—was selected to evaluate the ablation depth and quality. The results show that in moderate numbers of scan repeats (here 20, 30 & 40 times), it is advisable to adopt a minimum pulse energy when the same ablation depth is achieved compared to higher pulse energies. The ablation pile-up was also evaluated in these repeat ranges, indicating that higher pulse energies and repeats do not result in ablation improvement and cause excessive melt deposition.

Pt nanoparticles in cooperation with Mn-P composite drive base-free selective oxidation of 5-hydroxymethylfurfural

Selective oxidation of 5-hydroxymethylfurfural (HMF) to 2,5-furandicarboxylic acid (FDCA) is a key approach to sustainable upgrading of furfural based biomass resources. In this work, small Pt nanoparticles (about 2.1 nm) loaded on MnPnOx composite were shown to effectively drive the base-free aerobic oxidation of HMF to FDCA in water. Regulating the P content in carrier enabled to tune HMF conversion and product distribution. The optimal Pt/MnP0.5Ox catalyst can reach 98% yield of FDCA at 110 °C under 10 bar of O2 after 24 h. It also showed the highest initial conversion rate of HMF (13 mmol molPt−1 s−1) and productivity of FDCA (4.1 mmol molPt−1 h−1) among all the Pt/MnPnOx catalysts. The carrier effect of P addition on promoting Pt oxidation catalysis was elucidated by using rigorous kinetic investigations and comprehensive characterizations. The initial conversion rate, rate constant and apparent activation energy were independently measured on oxidation of HMF and its derived intermediates. ICP-MS, XRD, TEM, H2-TPR, O2-TPD and XPS were used to acquire catalytic properties. It was demonstrated that P addition led to changes in carrier structure and metal-support interaction, which eventually promoted the formation of highly active electron-rich Pt0 sites and mobile reactive defect oxygen species. These features allowed improving the selective oxidation catalysis of supported-Pt nanoparticles for the base-free conversion of HMF to FDCA.

Study of curing kinetics of 4‐ (dimethylsilyl) butyl ferrocene grafted HTPB and effect of catalysts by differential scanning calorimetry

AbstractThe cure kinetics of 4‐ (dimethylsilyl) butyl ferrocene grafted hydroxyl terminated polybutadiene (HTPB) with Isophorone diisocyante (IPDI) was investigated using differential scanning calorimeter (DSC). Furthermore, the catalytic effect of Iron (III) acetylacetonate (Fe(AA)3) and Dibutyltin dilaurate (DBTDL) on the curing reaction was studied. The experimental data was fitted to Kissinger and Ozawa models, and the kinetic parameters were expressed as Arrhenius activation energy (E), pre‐exponential factor (A) and rate constants. The Crane model was explored to determine the reaction order of the curing reaction. The study categorically showed that the activation energy of the curing reaction with 4‐ (dimethylsilyl) butyl ferrocene grafted HTPB is higher as compared to the pure hydroxyl terminated polybutadiene (HTPB) based system. However, the rate of curing reaction is higher with 4‐ (dimethylsilyl) butyl ferrocene grafted HTPB as compared to HTPB, and the viscosity build‐up data is too aligned with the DSC kinetic study. In addition, both catalysts increased the rate of the curing reaction but Fe(AA)3 displayed a superior catalytic effect.

Alternative Energy in Nigeria: Prospects and Limitations

Energy is a major driving ingredient to the development of any country and determines the quality of life a person lives. Accessibility to constant energy supply is a major challenge in this part of the world because the demand for energy is more than the supply, and since the nation’s major source of energy is fossil fuel, it’s only an eye-opener that our overdependence on this energy source doesn’t meet the demands since energy drives forward an economy, Nigeria could as well not be developed for a couple of number of years. Alternative energy sources are examined in this review especially the renewable source of energy in Nigeria. A delve into other (alternative) sources of energy were also looked into. This review also presents the projections and limits of the alternative sources of energy in Nigeria and the way forward. Policies that can be enacted to promote the use of alternative energy were also identified and some of the limitations were stretched out. Alternative energy sources should be considered priority in the country’s agenda since more than 60% of the nation’s population has access to the national grid of which constitutes more than half of the nation’s populace.

Multiple Self-Powered Sensor-Integrated Mobile Manipulator for Intelligent Environment Detection.

A multiple self-powered sensor-integrated mobile manipulator (MSIMM) system was proposed to address challenges in existing exploration devices, such as the need for a constant energy supply, limited variety of sensed information, and difficult human-computer interfaces. The MSIMM system integrates triboelectric nanogenerator (TENG)-based self-powered sensors, a bionic manipulator, and wireless gesture control, enhancing sensor data usability through machine learning. Specifically, the system includes a tracked vehicle platform carrying the manipulator and electronics, including a storage battery and a microcontroller unit (MCU). An integrated sensor glove and terminal application (APP) enable intuitive manipulator control, improving human-computer interaction. The system responds to and analyzes various environmental stimuli, including the droplet and fall height, temperature, pressure, material type, angles, angular velocity direction, and acceleration amplitude and direction. The manipulator, fabricated using 3D printing technology, integrates multiple sensors that generate electrical signals through the triboelectric effect of mechanical motion. These signals are classified using convolutional neural networks for accurate environmental monitoring. Our database shows signal recognition and classification accuracy exceeding 94%, with specific accuracies of 100% for pressure sensors, 99.55% for angle sensors, and 98.66, 95.91, 96.27, and 94.13% for material, droplet, temperature, and acceleration sensors, respectively.

Preparation and characterization of nano‐filled polypropylene dielectric films

AbstractModified copper calcium titanate (MCCTO) or functional activated carbon (FANC) particles were added to functional polypropylene (FPP) or heat‐treated polypropylene (HTFPP) matrix to improve the performance of FPP as dielectric films. By testing and characterizing the prepared FPPwxMCCTOy, FPPwxFANCz, FPPwxMCCTOyFANCz and HTFPPwxMCCTOy, HTFPPwxFANCy and HTFPPwxMCCTOyFANCz films, It is found that the dielectric constant and discharge energy density of each FPPwxMCCTOy, FPPwxFANCz, HTFPPwxFANCz and HTFPPwxFANCz films reach the maximum when the MCCTO and FANC loads are close to 8 and 6 wt% respectively. FPPwxMCCTO8FANCz and HTFPPwxMCCTO8FANCz series films also obtain the maximum dielectric constant and discharge energy density at FANC load approaching 6 wt%. The discharge energy density of HTFPPw86MCCTO8FANC6 film prepared properly is 3.2 J/cm3, which is more than 3 times higher than that of FPP. When MCCTO and FANC loads are ≦8 and 6 wt% respectively, with the increase of additive content, More dense distribution of MCCTO and FANC was observed in FPPwxMCCTOy(or HTFPPwxMCCTOy), FPPwxFANCz(or HTFPPwxFANCz) and FPPwxMCCTO8FANCz(or HTFPPwxMCCTO8FANCz) series film sections. In this paper, we propose possible explanations for the apparent improvement in dielectric constant, discharge energy density and heat resistance of capacitive films after appropriate heat treatment or addition of appropriate MCCTO and/or FANC loads.

Implantable Triboelectric Nanogenerators in the Biomedical Field

Implantable Triboelectric Nanogenerators (TENGs) have revolutionized the biomedical field by providing innovative power solutions for medical devices and enhancing diagnostic and therapeutic applications. Internally implanted TENG transforms kinetic energy from the body into electrical power, providing a constant energy supply for Implantable Medical Devices (IMD). Their ability to generate high voltage and low current makes them particularly effective for applications in biosensing, patient monitoring, and therapeutic interventions. Therapeutically, TENGs power cardiac pacemakers, promote wound healing, enhance bone regeneration, and support muscle and nerve stimulation. They also enable controlled drug release, particularly in targeted cancer treatments.

Thermodynamic investigation of biperiden hydrochloride and cyclodextrins supramolecular systems

Isothermal titration calorimetry (ITC) and theoretical calculations were used to investigate the interaction of cyclodextrins (CDs) with biperiden hydrochloride (BPR), a drug for Parkinson’s disease treatment. Among the natural CDs, βCD demonstrated the larger equilibrium constant (Keq = 9,020), demonstrating the cavity size dependency for the interaction. Carboxymethyl-β-cyclodextrin (CMβCD) demonstrated a stronger affinity and higher intermolecular complex stability. Additionally, the Keq for the CMβCD:BPR system varied from 68,100 at 298.15 K to 31,650 at 328.15 K, with a constant standard Gibbs free energy change. The theoretical calculations demonstrated the most stable structure for the CMβCD:BPR inclusion complex.

From biomass to Energy: Investigating Chlorella pyrenoidosa’s potential for fuel and carbon materials

This study investigated the bioenergy potential of Chlorella pyrenoidosa (CP) for use as fuel and carbon material through chemical and thermal characterization. The thermo-kinetic characteristics of Chlorella pyrenoidosa were assessed using isoconversional, linear regression, and non-linear regression approaches. The physicochemical analysis revealed high carbon (53.1 %), volatile (69.35 %), and low moisture (2.19 %), ash content (3.42 %). The results indicated that the non-linear model fitting method was the most accurate with the approximated activation energy (Eα) and pre-exponential Arrhenius constant (Ln A) were 124.92 ± 2.74 kJ/mol and 23.38 ± 4.63 min−1, respectively. Additionally, the inclusion of sodium bicarbonate resulted in a significant increase in BET surface area. FTIR analysis revealed several functional groups beneficial for carbon material, while XRD analysis showed a broad peak correlated with an amorphous structure. This study highlighted the potential of Chlorella pyrenoidosa biomass for various applications, including carbon material and renewable fuel.

Structural, optical, and morphological evaluation of PVA/Bi-Ni oxide-rGO nanocomposite casted films for optical devices applications

Herein, the polyvinyl alcohol (PVA) films doped with various concentrations of Bi2O3-NiO-rGO (BNG) nanoparticles were prepared through casting method. BNG nanoparticles were synthesized first using the co-precipitation method and then loaded into the polymer matrix. Various techniques like X-ray diffraction, Raman spectroscopy, and optical microscopes were used to determine the PVA’s structure after BNG nanoparticle additives. The thermal stability of the PVA’s film after the additive BNG nanoparticles was examined using the DSC technique. Furthermore, the optical parameters including bandgap energy (Eg), Urbach energy (EU), refractive index (n), optical conductivity, and optical dielectric constants were investigated via the absorbance and transmission data recorded using UV-visible spectroscopy. In addition, the photoemission spectra of the PVA matrix were determined after the inclusion of BNG nanoparticles. The Eg value decreases from 5.57 eV to 3.94 eV and from 4.8 eV to about 1.98 eV for direct and indirect transitions, respectively. While the EU value increases from 0.39 eV for pure PVA to about 3.23 eV for PVA: 4%BNG. The refractive index grows with the insertion of BNG to the PVA from 1.387 for pure PVA to about 5.157 for PVA: 4%BNG, which is a good suggestion for optical glasses applications. In addition, the increase in optical dielectric constants and optical conductivity with rising the BNG nanoparticle concentrations in the PVA matrix was confirmed. Such enhancement suggests the use of prepared samples in optical device applications.

Ligand Gaussian Accelerated Molecular Dynamics 3 (LiGaMD3): Improved Calculations of Binding Thermodynamics and Kinetics of Both Small Molecules and Flexible Peptides.

Binding thermodynamics and kinetics play critical roles in drug design. However, it has proven challenging to efficiently predict ligand binding thermodynamics and kinetics of small molecules and flexible peptides using conventional molecular dynamics (cMD), due to limited simulation time scales. Based on our previously developed ligand Gaussian accelerated molecular dynamics (LiGaMD) method, we present a new approach, termed "LiGaMD3″, in which we introduce triple boosts into three individual energy terms that play important roles in small-molecule/peptide dissociation, rebinding, and system conformational changes to improve the sampling efficiency of small-molecule/peptide interactions with target proteins. To validate the performance of LiGaMD3, MDM2 bound by a small molecule (Nutlin 3) and two highly flexible peptides (PMI and P53) were chosen as the model systems. LiGaMD3 could efficiently capture repetitive small-molecule/peptide dissociation and binding events within 2 μs simulations. The predicted binding kinetic constant rates and free energies from LiGaMD3 were in agreement with the available experimental values and previous simulation results. Therefore, LiGaMD3 provides a more general and efficient approach to capture dissociation and binding of both small-molecule ligands and flexible peptides, allowing for accurate prediction of their binding thermodynamics and kinetics.

Polypropylene nanocomposite film with enhanced energy storage performance via a continuous preparation

Dielectric polymers have been extensively employed in renewable energy conversion, hybrid electric vehicle, and high voltage direct current transmission systems, owing to their excellent electrical insulation, processability, and self-healing capability. However, the challenge lies in their relatively low dielectric constant (εr) and limited discharge energy density (Ue), which hinder the advancement of integrated power modules. Despite numerous efforts aimed at enhancing Ue, the fabrication of scalable dielectric film with both enhanced Ue and high charge–discharge efficiency (η) remains a major obstacle. Herein, the polypropylene-based films with BaTiO3@PP-g-MAH (BTO@PP-g-MAH) core–shell nanoparticles are prepared through a continuous melt extrusion process. The resulting nanocomposite film, incorporated with 5 wt% BTO@PP-g-MAH, exhibits an impressive Ue of 5.15 J cm−3 and achieves a high η of 93.2 % at 433 MV m−1, along with excellent cycle dielectric stability. Such enhancements in εr and Ue are ascribed to the improved interfacial polarization facilitated by BaTiO3 nanoparticles and the enhanced interface binding achieved through the PP-g-MAH shell layers. Furthermore, the enhancement of electric breakdown strength (Eb) is comprehensively investigated based on electrical breakdown mechanism and electromechanical breakdown model. This study demonstrates a novel strategy to prepare nanocomposite dielectric films that are compatible with commercial capacitor fabrication process.

Control of spin on structural stability, mechanical, magneto-optoelectronic and thermodynamic properties of RbTaX (X =P and As) materials: Emerging candidates for opto-spintronics and spin filter applications

In the present work, the density functional theory has been utilised in inspecting the ground state-structural, electronic, magnetic, optical, elastic and thermodynamic properties of new semiconductor RbTaX (X = P and As) half-Heuslers. Out of the possible three structures (α, β, γ) studied in ferromagnetic (FM) as well as non-magnetic (NM) phases, α – FM phase is found to be the most stable configuration. Both studied materials have estimated a net magnetic moment of 3μB, following the Slater-Pauling rule (Mtot=Ztot−8). With the use of modified Becke Johnson potential (mBJ) potential, the band profile reveals non-zero band gap in the spins and henceforth display spin filter property in the compounds. The predicted energy band gaps for RbTaP and RbTaAs are 3.04 and 2.87 eV for minority spin channels and 0.137 and 0.26 eV for majority spin channels, respectively. This unique feature of the Heusler compound may be advantageous for quantum information processing and spin-transport in electronic and magnetic devices. Also, a moderate exchange splitting and a Curie temperature well above the room temperature are noted. The stability of the materials under investigation was further confirmed by calculations of cohesive energy, formation energy, and second order elastic constants. The optoelectronic as well as thermodynamic properties of the studied compounds are also investigated. The estimated high value of refractive index (>4) is making them suitable for optical lenses. Moreover, photon energy absorption in the visible and ultraviolet spectrums renders them valuable for UV-VIS absorbers.