Electrical Conductivity Properties Research Articles

Piezoresistive properties of well-dispersed carbon nanotubes (CNTs) modified cement paste

When developing smart cement-based sensors with carbon nanotubes (CNTs) as conductive fillers, CNTs with good dispersion can enhance the conductivity and piezoresistive properties of cement-based materials. In this study, a combination of sonication and dispersant was used to disperse CNTs, and then investigated the piezoresistive properties of well-dispersed CNTs modified cement paste. The experimental results showed that the dispersant used was polyvinylpyrrolidone (PVP), and when the mass ratio of PVP to CNTs was 4:1, the sonication time was 25 min, and the standing time did not exceed 3 h, CNTs had higher dispersion quality. The resistivity of the cement paste decreased by two orders of magnitude with increasing CNTs dosage and exhibited visible percolation phenomenon with percolation thresholds ranging from 0.1 % to 0.3 %. The fractional change in resistivity, stress sensitivity and strain sensitivity of cement paste under cyclic loading reached the maximum values of 10.95 %, 1.146 %/MPa and 123.450 %, respectively, with high repeatability (92.63 %) and low hysteresis (8.40 %) when the content of CNTs was 0.4 %. At the same time, CNTs improved the microstructure of the cement paste, which positively affected the mechanical, electrical conductivity and piezoresistive properties of the material.

High electrical conductivity induced by charge transfer interactions in naphthalenediimide derivatives

Various studies have shown the influence of aliphatic, aromatic and bulky side chains on the optical, electrical conductivity and charge transport properties of naphthalenediimide (NDI) derivatives. The morphology, structural arrangement and the aggregation behaviour of these derivatives play an important role in influencing the charge transfer interactions between the donor and acceptor. These properties influence the electrical conductivity of the derivatives due to presence of charge transfer interactions. The present work focuses on the structure property relationship of the four NDI derivatives (SB-NDI) synthesized by imidization of dianhydride precursor with primary amine terminated Schiff bases (SB). The SB-NDI derivatives bear terminal phenyl ring attached to NDI through unsaturated or double unsaturated linkers bearing different electron withdrawing and donating groups. Among these, SB-NDI-2 derivative bearing –NO2 group in trans position at the terminal phenyl ring shows lowest –ΔGoET(CS) which allows favorable intramolecular charge separation. The Scanning electron microscopy shows ribbon like morphology for SB-NDI-2. The micron sized ribbons provide better charge transport and a conductivity of ∼1 Sm−1 at the room temperature without any additives. The special structure of SB-NDI provides charge transport properties allowing wide applications in the field of optoelectronics.

Super capacitive electrode performance analysis of facile synthesized α-Fe2O3 aerogel and its nanocomposite with in-situ formed polyaniline (α-Fe2O3/PANI)

This paper presents the synthesis of an α-Fe2O3-assisted polyaniline (α-Fe2O3/PANI) nanocomposite using a straightforward two-step process. Initially, α-Fe2O3 aerogels with cratered nanohexagon structures are synthesized through a solution combustion method assisted by noni (Morinda citrifolia) fruit extract. In the second step, these nanohexagons facilitate the preparation of α-Fe2O3/PANI via in-situ chemical oxidative polymerization of anilinium chloride. The structural, optical, and morphological properties were characterized using X-ray diffraction (XRD), Fourier-transform infrared spectroscopy (FTIR), and scanning electron microscopy with energy-dispersive X-ray analysis (SEM-EDAX). Electrical conductivity, wettability, and electrochemical properties of the prepared materials were assessed. The results indicate that the 2D cratered α-Fe2O3 aerogel is effectively embedded within PANI, forming a modified nano α-Fe2O3/PANI composite. The composite exhibited altered DC conductivity and electrolyte wettability. After 200 cycles of cyclic voltammetry (CV), the specific capacitance of the nano α-Fe2O3/PANI was determined to be 153 Fg⁻¹ at a scan rate of 10 mVs⁻¹, retaining approximately 90% of its cycle stability. Electrochemical impedance spectroscopy (EIS) revealed significantly lower charge transfer and equivalent series resistance values for the nano α-Fe2O3/PANI electrode compared to the pure α-Fe2O3-based electrode. Galvanostatic charge-discharge (GCD) tests further demonstrated the superior electrochemical performance of the α-Fe2O3/PANI nanocomposite electrode. Therefore, this α-Fe2O3/PANI is an advanced conducting polymeric electrode for electrochemical applications.

Lithographically Patternable SU-8/Graphene Nanocomposite based Strain Sensors for Soft-MEMS Applications

Abstract This paper presents an optimized, lithographically patternable SU-8/Graphene nanocomposite based piezoresistive strain sensor for localized, high-precision assessment, which marks a significant advancement in the field of soft-MEMS based technologies. The fabrication process involves the photolithography of a SU-8/Graphene nanocomposite with a minimum resolution of 50µm, resulting in a material with excellent electrical conductivity and mechanical properties. Specifically, a 3% SU-8/Graphene composition was chosen to exceed the percolation threshold, enabling substantial changes in the resistance %ΔR/R and facilitating photopatternability. The sensor exhibited exceptional performance characteristics, including a rapid response time of 0.1 seconds and a wide bending range from 0o to 60o. Notably, it demonstrated a remarkable %ΔR/R of 19.21, indicating its superior sensing capability. Such high sensitivity is crucial for applications that require precise, localized measurements, such as biomedical engineering, sports science, and smart healthcare.

Flexible LaNiO3 film with both high electrical conductivity and mechanical robustness

Lanthanum nickel oxide (LaNiO3, LNO) films exhibit excellent electrical conductivity but poor mechanical properties, considerably limiting their further development in the field of flexible electronics. In this study, flexible LNO thin films of different thicknesses were fabricated on a unique two-dimensional (2D) mica platform using a simple metal organic deposition technique. The obtained LNO films exhibited a pseudocubic phase without impurities. Scanning electron microscopy (SEM) and atomic force microscopy (AFM) characterisations proved that the films were well-crystallised, dense, and flat, with controllable thickness. In addition, the flexible LNO/mica element possesses low resistivity (5 × 10−4 Ω cm), translucency, and good bending resistance. The electrical resistivity can remain stable under various bending radii (r = 10∼2 mm), thousands of bending cycles, and a wide temperature range (28–200 °C), demonstrating good durability, mechanical stability and temperature resistance. Furthermore, a ferroelectric BiFeO3 film was constructed based on the obtained conductive LNO electrode, which exhibited typical ferroelectric characteristics. This excellent performance suggests that the flexible LNO electrode is promising for flexible electronic applications.

Study on the mechanical and electrical conductivity properties of waste short carbon fibers concrete and the establishment of conductivity models

The properties of waste short carbon fibers (WSCFs) were firstly characterized in this paper, and the effects of WSCFs with different lengths and contents on the mechanical properties and electrical conductivity of concrete were mainly investigated. Conductive model for WSCFs concrete was established based on the core-shell structure. The results revealed that, in comparison to virgin carbon fibers, WSCFs contained a small amount of resin, and the microscopic surface of WSCFs was smoother, but the content of C elements was low, the wettability and graphitization were poorer. The compressive strength of concrete did not significantly change after being mixed with WSCFs. Compared with the control group (0 %), only when the WSCFs content was 1 %, the compressive strength was slightly improved. The splitting tensile strength decreased as the length of WSCFs increased at the same content. When the length of WSCFs was 10 mm or 20 mm, the resistivity of concrete decreased by 86.0 % and 90.3 %, respectively, at 0.5 % content (28 d). As curing age increased, the free water inside the concrete decreased, and fibers were wrapped by hydration products, resulting in an increase of resistivity. Increasing the length of WSCFs from 10 mm to 20 mm effectively increased the probability of fiber overlap, constructing a more connected conductive network and reducing the conductive threshold of concrete from 0.5 % to 0.4 %. The established conductivity model for WSCFs concrete exhibited high calculation accuracy. The calculation results showed that for WSCFs with a length ranging from 10 mm to 50 mm, the concrete resistivity was very close and fluctuated less for the WSCFs content greater than 0.5 %.

A Perspective of Fabrication and Applications of MXene–Metal Hybrids

Abstract2D materials with ultrathin structure, high specific areas, and excellent mechanical properties provide potentials to enhance the electrical, mechanical, and chemical properties of metals. In particular, MXene with different compositions, abundant surface terminations, high electrical conductivity has good affinity with some metals such as Al, Li, Na as well as can be uniformly dispersed in the metals. Moreover, the above unique features enable the MXene–metal hybrids with diversified functions. In this review, the current advanced studies in the topic of MXene–metal hybrids are summarized. The properties of MXenes such as mechanical properties, electrical conductivity, wettability, and surface properties of MXenes are first reviewed. Subsequently, different synthetic approaches including physical, metallurgy, electrochemical, and wet‐chemical routes are screened. By harnessing the above unique features, MXene could enhance the electrical, mechanical, and chemical properties of the hybrids, and their application such as energy storage devices, anticorrosion coating, functional structural materials, electromagnetic wave absorption are highlighted. Finally, an outlook on the in‐operando characterization techniques is provided to clarify the strengthening mechanism of MXenes in metals, tailoration of interface between MXenes and metals, and urgent need for industrial‐scale manufacture of MXene–metal hybrids.

Role of Fe supplantation in tailoring structural, electrical conductivity, and magnetic properties in La2Ni1-xFexMnO6 double perovskites

Double perovskite system La2Ni1-xFexMnO6 (x = 0, 0.2, 0.5, 0.8 & 1.0) were developed using sol-gel method. Rietveld refinement revealed monoclinic structure (ordered) along with occurrence of rhombohedral and orthorhombic structures suggesting antisite cationic disorder. Crystallite size and average grain size of samples varied between 454 and 1058 Å and 0.774–1.429 μm respectively. XPS revealed the dual oxidation states of Ni, Fe, and Mn ions. La2NiMnO6 attained the highest DC conductivity among all compositions. The increase in DC conductivity with temperature suggested the semiconducting behavior of the samples, that explained by Thermal Activation (TA) and Variable Range Hopping (VRH) conduction mechanisms. Obtained activation energy(Edc) showed increasing trend with temperature. M-H loops exhibit a ferromagnetic nature accompanied by antiferromagnetic interactions as suggested by exchange bias and partially saturated loops. La2NiMnO6 attained the highest saturation magnetization (29.81emu/g) and decreased with Fe supplantation. The possible mechanism of tuning conductivity and magnetic properties of La2Ni1-xFexMnO6 has been discussed in detail.

Promising AlN-modified VS2 heterostructure for Li-ion battery anode with high specific capacity

Degradation of the interior structure and the formation of uncontrolled Li dendrites at the negative electrode during the process of detaching and embedding Li atoms in lithium-ion batteries (LIBs) can negatively impact the cycling operation of the battery. To address these shortcomings, we constructed AlN/VS2 heterostructure with the expectation that it can be deployed as anodes in LIBs. Our results show that the AlN/VS2 heterostructure is characterized by strong stability, enhanced electrical conductivity and mechanical properties compared to monolayer AlN and VS2. Small Li clusters and cross-layer adsorption models are not thermodynamically prone to form, implying that the anode material plays a positive role in inhibiting the formation of dendrites. Moreover, the specific capacity of the AlN/VS2 heterostructure is 816.2 mAh/g, which is higher than that of monolayer VS2 (466 mAh/g) and graphene (372 mAh/g). The results of ab-initio molecular dynamics (AIMD) and biaxial stretching further demonstrate the structural and electrochemical stability of the electrode material during the embedding of Li atoms. To sum up, the AlN/VS2 heterostructure show potential as a high-performance anode for utilization in LIBs.

Thixoforming of the Hot Extruded Aluminum AlSi9Cu3(Fe) Machining Chips

The main aim of this research was to investigate the aluminum AlSi9Cu3(Fe) machining chips recycling possibility utilizing a direct hot extrusion process and thixoforming. The thixo feedstock was prepared directly from the aluminum alloy AlSi9Cu3(Fe) machining chips waste without any remelting step. The machining chips were compacted, and direct hot extruded to create the solid samples and thixo feedstock. The aluminum alloy AlSi9Cu3(Fe) machining chips had a high degree of plastic deformation and after extrusion and heating in the semisolid temperature range, the suitable globular microstructure was achieved, which is a precondition for a successful thixoforming process. This approach can be characterized as a semisolid recycling process with a lower energy consumption, a higher material yield, and reduced greenhouse gas emissions into the atmosphere compared with conventional casting and recycling. Optical metallography, scanning electron microscopy accompanied with energy dispersive spectroscopy, electrical conductivity, and mechanical properties investigation were performed on the reference casted sample with a dendritic microstructure, the extruded sample with a severely deformed microstructure, and finally the thixoformed samples with a globular microstructure produced with different parameters, according to the Taguchi L4 (23) experimental plan.

Effect of synthesized copper oxide nanorods on electrical and thermal properties of compatibilized high‐density polyethylene/carbon nanofiber nanocomposite films

AbstractHigh‐density polyethylene (HDPE) nanocomposites containing different optimized fractions of carbon nanofiber (CNF) at 6 wt.%, polyethylene glycol (PEG) at 4 wt.%, and copper oxide (CuO) nanorods in concentration ranges of 0.15, 0.5, and 2 wt.% were successfully melt processed using corotating twin extrusion and compression molding technique. The effect of PEG and CuO nanofiller on the HDPE matrix were studied, particularly for the percolation threshold for electrical conductivity, structural morphology, and other properties including thermal stability, thermal conductivity (TC), dielectric, and UV protection properties. It is observed that PEG acts as a good compatibilizer, facilitating better interfacial connection between CNF and HDPE matrix. The optimized composite with 0.15 wt.% CuO nanorods (H/C6/P4/Cu0.15) shows a fine morphology and strong interfacial connections between fillers and the matrix, as observed in FE‐SEM micrographs. This optimized composite exhibits improved thermal stability, higher thermal conductivity (0.0404 W.K−1.m−1), increased dielectric constant, reduced electrical volume resistivity (from 2.1 × 1015 to 2.1 × 106 Ω.cm), and lower optical band gap value (2.74 eV). Additionally, all prepared nanocomposites offer approximately 100% Ultraviolet Protection Factor (UPF) rating for UV protection.Highlights The transformation of insulating HDPE into conducting HDPE composites. The effect of CuO nanorods was investigated in compatibilized HDPE composites. A percolation is achieved in the HDPE composite at 0.15 wt.% of CuO nanorods. PEG and CuO nanorods improved the multifunctional properties of the composite.

Cellulose nanofiber-induced metal–organic framework “armor” for the fabrication of carbon fibre composites with enhanced mechanical properties and electrical conductivity

Metal-organic frameworks (MOFs) possess significant potential in enhancing the interfacial performance of composites owing to their exceptional skeletal structures and substantial specific surface area. Herein, we prepared typical conductive MOFs (Ni-HHTP, HHTP = 2, 3, 6, 7, 10, 11-hexahydroxybenzene) at the interface by in situ synthesis using cellulose nanofibers (CNFs) assembled on the surface of carbon fibres (CFs) as precursors. CNFs can not only act as a smart cushion to promote stress release but also provide abundant oxygen-containing functional groups, such as hydroxyl and carboxyl groups, which can facilitate the growth of MOF on the surface of CFs. Furthermore, MOFs with porous structure and large specific surface area increase the interphase region for interfacial load transmission. The CF composites prepared using this strategy exhibited improvements in interlaminar shear strength (ILSS), interfacial shear strength (IFSS), flexural strength and flexural modulus by 57.9 %, 54.9 %, 35.1 % and 46.7 %, respectively. Additionally, the electrical conductivities of the composites in both thickness and in-plane directions were 1.04 × 10−4 S/cm and 7.3770 S/cm, respectively, which was attributed to the MOFs on the surface of the fibres facilitating the formation of good conductive channels between the fibres and resin. This study proposes an advanced interfacial modification approach to prepare CF composites with excellent mechanical and electrical conductivity properties.

Enhancing electrical conductivity and mechanical properties of decellularized umbilical cord arteries using graphene coatings.

Traditional decellularized bioscaffolds possessing intact vascular networks and unique architecture have been extensively studied as conduits for repairing nerve damage. However, they are limited by the absence of electrical conductivity, which is crucial for proper functioning of nervous tissue. This study focuses on investigating decellularized umbilical cord arteries by applying coatings of graphene oxide (GO) and reduced graphene oxide (RGO) to their inner surfaces. This resulted in a homogeneous GO coating that fully covered the internal lumen of the arteries. The results of electrical measurements demonstrated that the conductivity of the scaffolds could be significantly enhanced by incorporating RGO and GO conductive sheets. At a low frequency of 0.1 Hz, the electrical resistance level of the coated scaffolds decreased by 99.8% with RGO and 98.21% with GO, compared with uncoated scaffolds. Additionally, the mechanical properties of the arteries improved by 24.69% with GO and 32.9% with RGO after the decellularization process. The GO and RGO coatings did not compromise the adhesion of endothelial cells and promoted cell growth. The cytotoxicity tests revealed that cell survival rate increased over time with RGO, while it decreased with GO, indicating the time-dependent effect on the cytotoxicity of GO and RGO. Blood compatibility evaluations showed that graphene nanomaterials did not induce hemolysis but exhibited some tendency toward blood coagulation.

Enhanced electrical conductivity and mechanical property with antioxidant hydrogel for neural injury repair: In vitro analysis

The combined effect of endogenous electrical conductivity and antioxidant properties is a promising strategy for repairing and regenerating injured spinal cord tissue. Here, we focus on the development of biocompatible, antioxidant hydrogel scaffold with conductivity and modulus similar to the native spinal cord based on Hyaluronic (HA)/Histidine (His)/ Gelatin (Gel) with polyaniline (PANI). The physiochemical characterizations of the prepared materials were analyzed via NMR, FT-IR, XRD, SEM, and TEM techniques. The HA-His-Gel-PANI hydrogel's electrical conductivity and compressive modulus observed were 0.02S/cm and 2.18 ± 0.68 kPa, matching the native spinal tissues. The in vitro studies of HA-His-Gel-PANI hydrogel against the PC-12 cell line revealed that the prepared conductive hydrogel shows higher cell viability, antioxidant, and cell migration properties. Thus, HA-His-Gel-PANI hydrogel shows a promising ability for neural injury regeneration and may improve the therapeutic application of neural injury regenerative medicine.

Investigations on electrical conductivity and dielectric properties of p-type ZnO by doping N synthesized from sol–gel method

Investigations on electrical conductivity and dielectric properties of p-type ZnO by doping N synthesized from sol–gel method

Impact of varying magnetite nanoparticle concentrations on the structural, electrical, and magnetic properties of polyaniline-based magnetic nanocomposites

We report the synthesis of polyaniline/magnetite nanocomposites (PMNCs) via in situ chemical oxidation polymerization of aniline with magnetite nanoparticles (MNPs) at 5, 12, and 25 wt%. The objective was to evaluate how the MNPs’ proportion affects the electrical, magnetic, and structural properties, which were investigated using XRD, EDXRF, TEM, EIS, ESR spectroscopy, Mössbauer spectroscopy, and VSM. EDXRF confirmed the formation of MNPs, while XRD revealed the crystalline nature of MNPs and the semicrystalline structure of PANI, with a decrease crystallinity index as the MNPs percentage increased. TEM showed PANI encapsulating MNPs with average diameters of 9.7 ± 2, 9.9 ± 2, and 13.1 ± 3 nm for PMNC25, PMNC12, and PMNC5, respectively. Conductivity values of PANI, PMNC25, PMNC12 and PMNC5 were 7.96 ×10⁻⁴, 1.38 ×10⁻⁴, 2.19 ×10⁻⁴ and 2.31 ×10⁻⁴ S/cm, respectively. ESR indicated cationic radicals responsible for conductivity. Saturation magnetization (Ms) for MNPs, PMNC25, PMNC12 and PMNC5 were 93.4, 24.6, 11.8 and 5.6 emu/g, respectively, with superparamagnetic behavior observed. Our findings show that incorporating MNPs into the PANI matrix modulates electrical conductivity and magnetic properties while maintaining the nanocomposite’s structure, highlighting the multifunctional potential of these composites.

Effect of friction-stir processing and subsequent aging treatment on microstructure and service properties of cu-Cr-Zr alloy

The effect of friction-stir processing (FSP) and the subsequent aging treatment on the microstructure, electrical conductivity, and mechanical properties of a Cu-0.3%Cr-0.5%Zr alloy was studied. FSP promoted complex microstructural changes, including significant grain refinement and dissolution of secondary particles within the stir zone and particle coarsening within the heat-affected zone. The particle phenomena resulted in the essential material softening and degradation of electrical conductivity. The subsequent aging treatment provided particle reprecipitation within the stir zone and thus essentially recovered material properties in this area. In the heat-affected zone, however, the recovery effect was less pronounced, thus leading to the characteristic W-shaped profiles of microhardness and electrical conductivity. This result was attributed to the insufficient degree of supersaturation of the solid solution in this microstructural region, which, in turn, promoted the relatively slow precipitation kinetics.

Dielectric behaviour, impedance and conductivity studies of YBaYbSiO oxy-apatite compounds

This paper reports the dielectric behaviour and electrical conduction properties of Y6-xBa4Ybx(SiO4)6O2 (YBaSiO: xYb) compounds. The Scanning Electron Microscopy (SEM) was utilized to obtain the surface microstructure of the compound. The micrographs showed both the circular and elongated shape of grains and their random distribution. The Fourier Transform Infrared Spectroscopy (FTIR) was used to confirm the presence of bond formations in the compounds. From the spectra, it was observed that the peaks at 690 cm−1 and a band from 850 cm−1 to 998 cm−1 are due to the stretching frequency of Y-O molecules and Si-O molecules, respectively. The peak centred at 1464 cm−1 is of vibration modes of Ba2+ions. These peaks confirmed the formation of oxy-apatite compounds. Both the dielectric permittivity and dielectric loss, decreases with increasing values of frequency due to reduction in the polarization effects on the higher side of frequency. This is because the dipole orientation lags with the rapidly reversing alternating current (ac) field. The value of dielectric loss was found to range between, 0 – 3.5 in frequency ∼ 100 Hz and 0 – 0.5 in frequency ∼ 100,000 Hz, up to temperature 500 °C. The impedance value decreases and hence a. c. conductivity increases, at higher frequencies. The increment in ac values followed the universal power law. The Nyquist plot showed that the area under the curves reduces and hence indicates negative temperature coefficient of resistance i.e., NTCR behaviour of compounds. The obtained results suggest the utilization of compound in electrical devices as power loss component, solid oxide fuel cells, and capacitors etc.

The effect of transition metal ion implantation on the structural and optical properties of few-layered borophene

Borophene, a monometallic two-dimensional layered material has gained significant attention due to its exceptional electrical and optical properties. Despite this, borophene layers tend to restack; retards ionic conductivity, imperative for practical applications. Thus, by introducing large-sized dopants into borophene nanosheets using an ion implantation technique has been acknowledged. Accordingly, herein, structural and electronic engineering of borophene has been done with implantation of copper (Cu) ions at various fluence rates (5 × 1012, 5 × 1013, 5 × 1014 and 5 × 1015 ions-cm−2 respectively) using 1μA current at a low energy of 80 keV. The Cu insertion between borophene interlayers prevents self-restacking; providing surfacial active sites with tunable work function and decreased band gap of pristine borophene, thereby increasing charge transport ability. Further, the structural properties of implanted borophene were characterized through Raman spectroscopy, FT-IR spectroscopy and optical properties using UV–Vis and photoluminescence studies. Also, I-V measurements were conducted to study the electrical properties. Hence, ion implantation helps in significantly enhance the electrical conductivity and transportation properties of borophene.

Synthesis of reduced graphene oxide and Nickel oxide/reduced graphene oxide composite materials for supercapacitor applications and their computational investigations

This study outlines the synthesis of reduced graphene oxide (rGO) and Nickel oxide/reduced graphene oxide (NiO/rGO) composite materials without the use of binders. The synthesis method involved microwave-assisted reduction using ascorbic acid (AA) and varying weight ratios of potassium hydroxide (KOH) to convert graphene oxide (GO) to rGO. The research investigates how adjusting the weight ratios of GO and KOH influences the electrical conductivity (EC) properties of the synthesized materials, particularly exploring the impact of KOH addition on the porosity growth in the rGO layers during fabrication. Various analytical techniques, including optical, vibrational, morphological, bonding, and network analysis, were employed to characterize the synthesized materials. The materials were evaluated as potential supercapacitor electrodes using electrochemical techniques such as cyclic voltammetry and A.C. impedance analysis, including Nyquist and Bode plots. The specific capacitance (CS) of rGO and NiO/rGO was determined to be 1400 Fg−1 at a scan rate of 0.005 Vs−1. The synthesis process avoided the use of hazardous reagents. Additionally, density functional theory (DFT) based computational analysis was conducted to support the experimental findings. The study documents the influence of incorporating NiO onto the surface of GO and rGO on the energy gap (Egap) and investigates the density of state (DOS) to understand the effect of MO-rGO interaction. Furthermore, frontier molecular orbital (FMO) contours were examined to analyze excitation qualities, and electron potential was visualized and mapped onto the electron density surface to gain insights into charge dispersion within the structures.