Pub Date : 2024-09-23DOI: 10.1007/s12043-024-02817-z
P Mehana, N S Rajeswari
The Yukawa-plus-exponential model (YEM) is the modified form of liquid drop model incorporating parameter to include short-range interaction and surface diffuseness. We have studied two-proton (2p) radioactivity within the YEM for spherical nuclei in our previous work [Mehana and Rajeswari in Eur. Phys. J. A 59, 104 (2023)]. The present study is the extension of the previous work to apply the model to deformed 2p emitters. Deformation is incorporated in YEM through Coulomb potential and Yukawa interaction potential. The calculated half-lives are found to have less deviation than experimental half-lives, when compared to spherical ones. Further, half-lives are also predicted for 2p emitters which are not yet studied experimentally. The calculated half-lives show good match with half-lives predicted by other theoretical models. It is seen that the half-lives of the prolate-shaped daughter nuclei are lower than spherical nuclei of the same parent, whereas the half-lives of oblate daughters are higher than that of the spherical ones.
汤川加指数模型(YEM)是液滴模型的改进形式,其中包含短程相互作用和表面扩散参数。我们在以前的工作中[Mehana 和 Rajeswari 在 Eur. Phys. J. A 59, 104 (2023)]研究了 YEM 中球形原子核的双质子(2p)放射性。本研究是前一项工作的延伸,将模型应用于变形 2p 发射体。变形是通过库仑势和尤卡娃相互作用势纳入 YEM 的。与球形半衰期相比,计算得出的半衰期与实验半衰期的偏差较小。此外,还预测了尚未进行实验研究的 2p 发射器的半衰期。计算得出的半衰期与其他理论模型预测的半衰期非常吻合。可以看出,长球形子核的半衰期低于相同母核的球形子核,而扁球形子核的半衰期高于球形子核。
{"title":"Two-proton emission within a deformed Yukawa-plus-exponential model","authors":"P Mehana, N S Rajeswari","doi":"10.1007/s12043-024-02817-z","DOIUrl":"10.1007/s12043-024-02817-z","url":null,"abstract":"<div><p>The Yukawa-plus-exponential model (YEM) is the modified form of liquid drop model incorporating parameter to include short-range interaction and surface diffuseness. We have studied two-proton (2p) radioactivity within the YEM for spherical nuclei in our previous work [Mehana and Rajeswari in <i>Eur. Phys. J.</i> A <b>59</b>, 104 (2023)]. The present study is the extension of the previous work to apply the model to deformed 2p emitters. Deformation is incorporated in YEM through Coulomb potential and Yukawa interaction potential. The calculated half-lives are found to have less deviation than experimental half-lives, when compared to spherical ones. Further, half-lives are also predicted for 2p emitters which are not yet studied experimentally. The calculated half-lives show good match with half-lives predicted by other theoretical models. It is seen that the half-lives of the prolate-shaped daughter nuclei are lower than spherical nuclei of the same parent, whereas the half-lives of oblate daughters are higher than that of the spherical ones.\u0000</p></div>","PeriodicalId":743,"journal":{"name":"Pramana","volume":null,"pages":null},"PeriodicalIF":1.9,"publicationDate":"2024-09-23","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142413317","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"物理与天体物理","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2024-09-13DOI: 10.1007/s12043-024-02744-z
Xia Wu, Xiaoling Qiu, Limi Hu
Two different control methods are proposed in this paper to effectively control the chaotic phenomenon of nonlinear dynamical system. One is a new Hamilton energy feedback control method based on Helmholtz’s theorem, which reduces the Lyapunov exponents value of the system by adjusting the feedback gain for controlling chaos. The other is to control the chaos of the system by using delayed feedback control method. Based on this method, we consider the local asymptotic stability of the equilibrium point of the system, and give conditions for the existence of the Hopf bifurcation of the system and the stability domain of the delay parameters. By using the centre manifold theorem and the Poincare normal form method, specific formulas for determining the direction of Hopf bifurcation and the stability of the bifurcation periodic solutions are derived. Finally, the simulation results show that chaos can be controlled by choosing appropriate time-delay parameters.
{"title":"Dynamic analysis and chaos control of a unified chaotic system","authors":"Xia Wu, Xiaoling Qiu, Limi Hu","doi":"10.1007/s12043-024-02744-z","DOIUrl":"10.1007/s12043-024-02744-z","url":null,"abstract":"<div><p>Two different control methods are proposed in this paper to effectively control the chaotic phenomenon of nonlinear dynamical system. One is a new Hamilton energy feedback control method based on Helmholtz’s theorem, which reduces the Lyapunov exponents value of the system by adjusting the feedback gain for controlling chaos. The other is to control the chaos of the system by using delayed feedback control method. Based on this method, we consider the local asymptotic stability of the equilibrium point of the system, and give conditions for the existence of the Hopf bifurcation of the system and the stability domain of the delay parameters. By using the centre manifold theorem and the Poincare normal form method, specific formulas for determining the direction of Hopf bifurcation and the stability of the bifurcation periodic solutions are derived. Finally, the simulation results show that chaos can be controlled by choosing appropriate time-delay parameters.\u0000</p></div>","PeriodicalId":743,"journal":{"name":"Pramana","volume":null,"pages":null},"PeriodicalIF":1.9,"publicationDate":"2024-09-13","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142204334","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"物理与天体物理","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2024-09-11DOI: 10.1007/s12043-024-02815-1
A T Shafeek, M A Bakry, G M Moatimid
This paper explores the evolution of gravastars within the context of the Lyra geometry. The mathematical formulations of the three regions of a gravastar: (i) the inside region, (ii) the shell region and (iii) the external void region are described separately, along with their physical characteristics and graphical representations. The study explores different aspects of our model by analysing the behaviour of physical parameters. It solves the modified Einstein’s field equations, which are derived from this geometry, under the conditions of gravastar formation. The investigation focusses on the physical properties of the shell region, such as energy density, proper length, full energy, entropy, surface tension, thinness and energy conditions. Additionally, the stability of the gravastar model is examined by analysing the surface red-shift in relation to the shell length.
{"title":"Gravastars in the Lyra geometry","authors":"A T Shafeek, M A Bakry, G M Moatimid","doi":"10.1007/s12043-024-02815-1","DOIUrl":"10.1007/s12043-024-02815-1","url":null,"abstract":"<div><p>This paper explores the evolution of gravastars within the context of the Lyra geometry. The mathematical formulations of the three regions of a gravastar: (i) the inside region, (ii) the shell region and (iii) the external void region are described separately, along with their physical characteristics and graphical representations. The study explores different aspects of our model by analysing the behaviour of physical parameters. It solves the modified Einstein’s field equations, which are derived from this geometry, under the conditions of gravastar formation. The investigation focusses on the physical properties of the shell region, such as energy density, proper length, full energy, entropy, surface tension, thinness and energy conditions. Additionally, the stability of the gravastar model is examined by analysing the surface red-shift in relation to the shell length.</p></div>","PeriodicalId":743,"journal":{"name":"Pramana","volume":null,"pages":null},"PeriodicalIF":1.9,"publicationDate":"2024-09-11","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142204336","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"物理与天体物理","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2024-09-11DOI: 10.1007/s12043-024-02822-2
Yu Zhang, Chen Diao, Ning Cai
Computer model has been extensively adopted to overcome the time limitation of language evolution by transforming language theory into physical modelling mechanism, which helps to explore the general laws of evolution. In this paper, a model is designed to simulate the evolution process of languages in human settlements, with the associated network topology being lattice. The language of each node in the lattice will evolve gradually under the influence of its own fixed evolutionary direction and neighbours. According to the computational experiment results, it is discovered that the state points of languages always converge into several clusters during the evolution process, which gives us an insight into language evolution.
{"title":"On universality of clustering in natural evolution of particle systems: taking human languages as an example","authors":"Yu Zhang, Chen Diao, Ning Cai","doi":"10.1007/s12043-024-02822-2","DOIUrl":"10.1007/s12043-024-02822-2","url":null,"abstract":"<div><p>Computer model has been extensively adopted to overcome the time limitation of language evolution by transforming language theory into physical modelling mechanism, which helps to explore the general laws of evolution. In this paper, a model is designed to simulate the evolution process of languages in human settlements, with the associated network topology being lattice. The language of each node in the lattice will evolve gradually under the influence of its own fixed evolutionary direction and neighbours. According to the computational experiment results, it is discovered that the state points of languages always converge into several clusters during the evolution process, which gives us an insight into language evolution.\u0000</p></div>","PeriodicalId":743,"journal":{"name":"Pramana","volume":null,"pages":null},"PeriodicalIF":1.9,"publicationDate":"2024-09-11","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142204337","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"物理与天体物理","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
This article presents an analysis and control approach for a non-smooth air-gap permanent magnet synchronous motor (NSAG-PMSM) in the absence of external disturbances. The analytical study of NSAG-PMSM shows the existence of equilibrium points. Based on the Routh–Hurwitz criterion, the stability of the equilibrium points reveals the existence of transcritical bifurcation. NSAG-PMSM exhibits various dynamical behaviours, such as bistable chaos, periodic spiking oscillations, chaotic spiking characteristics, coexistence between periodic and chaotic behaviours and periodic evolution towards monostable chaos as system parameters change. The research uses microcontroller implementation to validate the dynamical characteristics observed during the numerical simulations of the NSAG-PMSM. The study of NSAG-PMSM proposes a strategy to mitigate chaos and stabilise the system using two simple controllers, with a comparative study presented using peak overshoot and settling time diagrams. By combining these different aspects, this article significantly contributes to the understanding of the operation in NSAG-PMSM, highlighting specific aspects related to the application of microcontroller techniques in the field of electrical engineering and solutions to chaos control.
{"title":"Analysis, microcontroller implementation and chaos control of non-smooth air-gap permanent magnet synchronous motor","authors":"Giles Yamdjeu, Balakrishnan Sriram, Sifeu Takougang Kingni, Karthikeyan Rajagopal, Alidou Mohamadou","doi":"10.1007/s12043-024-02799-y","DOIUrl":"10.1007/s12043-024-02799-y","url":null,"abstract":"<div><p>This article presents an analysis and control approach for a non-smooth air-gap permanent magnet synchronous motor (NSAG-PMSM) in the absence of external disturbances. The analytical study of NSAG-PMSM shows the existence of equilibrium points. Based on the Routh–Hurwitz criterion, the stability of the equilibrium points reveals the existence of transcritical bifurcation. NSAG-PMSM exhibits various dynamical behaviours, such as bistable chaos, periodic spiking oscillations, chaotic spiking characteristics, coexistence between periodic and chaotic behaviours and periodic evolution towards monostable chaos as system parameters change. The research uses microcontroller implementation to validate the dynamical characteristics observed during the numerical simulations of the NSAG-PMSM. The study of NSAG-PMSM proposes a strategy to mitigate chaos and stabilise the system using two simple controllers, with a comparative study presented using peak overshoot and settling time diagrams. By combining these different aspects, this article significantly contributes to the understanding of the operation in NSAG-PMSM, highlighting specific aspects related to the application of microcontroller techniques in the field of electrical engineering and solutions to chaos control.\u0000</p></div>","PeriodicalId":743,"journal":{"name":"Pramana","volume":null,"pages":null},"PeriodicalIF":1.9,"publicationDate":"2024-09-11","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142204335","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"物理与天体物理","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2024-08-28DOI: 10.1007/s12043-024-02791-6
Bo Liu, Zhou-Bo Duan, Li-Fang Niu
In this paper, we study the travelling wave parametric amplifier-superconducting nonlinear asymmetric inductive element (TWPA-SNAIL) transmission line circuit equation and its variable coefficients form, which may describe transmission line circuits for travelling wave parametric amplifiers including superconducting nonlinear asymmetric inductive elements. We derive some exact solutions, including dark soliton, bright soliton, periodic, trigonometric function and hyperbolic function solutions using Jacobi elliptic function expansion method. The soliton solutions of this circuit equation are useful to analogue black–white hole event horizon pairs. To better describe the dynamical behaviour of these solutions, we plot three-dimensional density and two-dimensional images. By varying the parameters, we find that some parameters have an effect on the structure of the solution. In addition, for the variable coefficient equations, we present images containing trigonometric and exponential functions in the solution and obtain some satisfactory results by comparing the graphs with the coefficient functions. The results show that the Jacobi elliptic function expansion method is a remarkable, direct and desirable method for solving a class of nonlinear partial differential equations.
{"title":"Soliton solutions of the TWPA-SNAIL transmission line circuit equation under continuum approximation via the Jacobi elliptic function expansion method","authors":"Bo Liu, Zhou-Bo Duan, Li-Fang Niu","doi":"10.1007/s12043-024-02791-6","DOIUrl":"10.1007/s12043-024-02791-6","url":null,"abstract":"<div><p>In this paper, we study the travelling wave parametric amplifier-superconducting nonlinear asymmetric inductive element (TWPA-SNAIL) transmission line circuit equation and its variable coefficients form, which may describe transmission line circuits for travelling wave parametric amplifiers including superconducting nonlinear asymmetric inductive elements. We derive some exact solutions, including dark soliton, bright soliton, periodic, trigonometric function and hyperbolic function solutions using Jacobi elliptic function expansion method. The soliton solutions of this circuit equation are useful to analogue black–white hole event horizon pairs. To better describe the dynamical behaviour of these solutions, we plot three-dimensional density and two-dimensional images. By varying the parameters, we find that some parameters have an effect on the structure of the solution. In addition, for the variable coefficient equations, we present images containing trigonometric and exponential functions in the solution and obtain some satisfactory results by comparing the graphs with the coefficient functions. The results show that the Jacobi elliptic function expansion method is a remarkable, direct and desirable method for solving a class of nonlinear partial differential equations.</p></div>","PeriodicalId":743,"journal":{"name":"Pramana","volume":null,"pages":null},"PeriodicalIF":1.9,"publicationDate":"2024-08-28","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142204338","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"物理与天体物理","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2024-08-28DOI: 10.1007/s12043-024-02798-z
S Bilal, Safia Akram, Maria Athar, Khalid Saeed, Alia Razia, Arshad Riaz
Aerospace research is increasingly focusing on propulsion system analysis. Heat transmission at high temperatures controlled by thermal radiation is used in spaceship propulsion systems. Hence, the current work investigates the magneto-Williamson nanofluid peristalsis flow in relation to thermal effect and slip-boundary circumstances with double-diffusion convection. In the flow's opposite direction, a steady, static magnetic field is applied. A mathematical model with appropriate boundary conditions is built by considering the momentum, continuity and energy equations. By considering the long wavelength and low Reynold estimation, the resulting equations are further made simpler. Then a numerical solution to the resulting reduced partial differential equations is obtained. Finally, there is a visual representation of the non-Newtonian propelling flow parameters, which include the Brinkman number, Prandtl number, Hartmann number, radiation parameter, particle volume fraction, electric field and slip parameters. It is highlighted that enhancing the coefficient of thermophoresis strengthens the temperature contour because increasing the number of particles merged enhances thermophoretic power. Furthermore, because of the substantial migration of nanoparticles from a heated region to a cooled one, the distribution of concentration becomes less cumbersome. It is also revealed that the fraction of nanoparticles rises because of rising thermal radiation and Brownian motion because nanofluids have a significant temperature distribution that may affect the system's distribution.
{"title":"Numerical analysis on theoretical model of magneto-Williamson nanofluid in relation to viscous dissipation, double-diffusion convection, thermal radiation and multiple slip boundaries","authors":"S Bilal, Safia Akram, Maria Athar, Khalid Saeed, Alia Razia, Arshad Riaz","doi":"10.1007/s12043-024-02798-z","DOIUrl":"10.1007/s12043-024-02798-z","url":null,"abstract":"<div><p>Aerospace research is increasingly focusing on propulsion system analysis. Heat transmission at high temperatures controlled by thermal radiation is used in spaceship propulsion systems. Hence, the current work investigates the magneto-Williamson nanofluid peristalsis flow in relation to thermal effect and slip-boundary circumstances with double-diffusion convection. In the flow's opposite direction, a steady, static magnetic field is applied. A mathematical model with appropriate boundary conditions is built by considering the momentum, continuity and energy equations. By considering the long wavelength and low Reynold estimation, the resulting equations are further made simpler. Then a numerical solution to the resulting reduced partial differential equations is obtained. Finally, there is a visual representation of the non-Newtonian propelling flow parameters, which include the Brinkman number, Prandtl number, Hartmann number, radiation parameter, particle volume fraction, electric field and slip parameters. It is highlighted that enhancing the coefficient of thermophoresis strengthens the temperature contour because increasing the number of particles merged enhances thermophoretic power. Furthermore, because of the substantial migration of nanoparticles from a heated region to a cooled one, the distribution of concentration becomes less cumbersome. It is also revealed that the fraction of nanoparticles rises because of rising thermal radiation and Brownian motion because nanofluids have a significant temperature distribution that may affect the system's distribution.</p></div>","PeriodicalId":743,"journal":{"name":"Pramana","volume":null,"pages":null},"PeriodicalIF":1.9,"publicationDate":"2024-08-28","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142204339","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"物理与天体物理","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2024-08-27DOI: 10.1007/s12043-024-02823-1
K Chandan, R S Varun Kumar, Naman Sharma, K Karthik, K V Nagaraja, Taseer Muhammad, Jasgurpreet Singh Chohan
The radiation impact on the thermal distribution of the radial fin with the temperature-dependent thermal conductivity is discussed in this paper. The basic governing heat equation of the radial fin is formulated with the assistance of the Fourier law of heat conduction. The dimensional heat equation of the radial fin is non-dimensionalised utilising appropriate dimensionless variables and this ordinary differential equation (ODE) is tackled by employing the physics-informed neural network (PINN) scheme. The thermal attributes of the radial fin are investigated for different parameters like convection–conduction parameter, radiation–conduction parameter and thermal conductivity parameter. The outcomes of the systematic assessments of these parameters are demonstrated with the support of graphs. The rise in the thermal conductivity variable promotes thermal variation in the fin. A decrease in radiative–conductive variable scales augments the temperature dispersal through the fin. Furthermore, PINN incorporates physics equations directly into its architecture, unlike standard numerical approaches, which frequently require extensive mathematical expertise for accuracy. This approach enables PINN to give precise findings even when working with minimal training data, saving substantial time and resources.
{"title":"Advanced deep learning approach with physics-informed neural networks for analysing the thermal variation through a radial fin applicable in heat exchangers","authors":"K Chandan, R S Varun Kumar, Naman Sharma, K Karthik, K V Nagaraja, Taseer Muhammad, Jasgurpreet Singh Chohan","doi":"10.1007/s12043-024-02823-1","DOIUrl":"10.1007/s12043-024-02823-1","url":null,"abstract":"<div><p>The radiation impact on the thermal distribution of the radial fin with the temperature-dependent thermal conductivity is discussed in this paper. The basic governing heat equation of the radial fin is formulated with the assistance of the Fourier law of heat conduction. The dimensional heat equation of the radial fin is non-dimensionalised utilising appropriate dimensionless variables and this ordinary differential equation (ODE) is tackled by employing the physics-informed neural network (PINN) scheme. The thermal attributes of the radial fin are investigated for different parameters like convection–conduction parameter, radiation–conduction parameter and thermal conductivity parameter. The outcomes of the systematic assessments of these parameters are demonstrated with the support of graphs. The rise in the thermal conductivity variable promotes thermal variation in the fin. A decrease in radiative–conductive variable scales augments the temperature dispersal through the fin. Furthermore, PINN incorporates physics equations directly into its architecture, unlike standard numerical approaches, which frequently require extensive mathematical expertise for accuracy. This approach enables PINN to give precise findings even when working with minimal training data, saving substantial time and resources.</p></div>","PeriodicalId":743,"journal":{"name":"Pramana","volume":null,"pages":null},"PeriodicalIF":1.9,"publicationDate":"2024-08-27","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142204340","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"物理与天体物理","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2024-08-23DOI: 10.1007/s12043-024-02759-6
O Farkad, R Takassa, F Elfatouaki, S Hassine, A El mouncharih, O Choukri, A Ouahdani, E A Ibnouelghazi, D Abouelaoualim
Modifying electrical and optical properties in two-carbon materials is essential for electronic devices, energy storage and biosensor applications. We report a comparative study of the effect of systematically intercalated strontium atoms in AA- and AB-stacked bilayer graphene (BG) in the framework of density functional theory (DFT). The electronic band structures, the total and partial electronic density of states and the dielectric function are studied. We show that the intercalation of atoms can influence both electronic properties. Our results show that the Dirac cones, a signature of graphene, are translated into the conduction band. This property may be useful in band-gap tuning applications of nanodevices. The optical properties were calculated parallel and perpendicular to the graphene sheet under polarised electric fields. The calculated optical properties show that the intercalation of Sr in the AA- and AB-stacked BGs promotes IR absorption. The findings provide a basis for developing graphene intercalary compounds, which can be used in optoelectronics to control the absorption of light wavelengths and specifically in biosensor applications.
改变双碳材料的电气和光学特性对于电子设备、能量存储和生物传感器应用至关重要。我们报告了在密度泛函理论(DFT)框架内对 AA 层和 AB 层双层石墨烯(BG)中系统插层锶原子的影响进行的比较研究。研究了电子能带结构、总态和部分态电子密度以及介电函数。我们发现原子的插层会影响这两种电子特性。我们的研究结果表明,作为石墨烯特征的狄拉克锥被转化为导带。这一特性可能有助于纳米器件的带隙调整应用。在极化电场作用下,平行和垂直于石墨烯薄片的光学特性都得到了计算。计算得出的光学特性表明,在 AA 和 AB 层叠的石墨烯中掺入锶可促进红外吸收。这些发现为开发石墨烯插层化合物提供了基础,这种化合物可用于光电子学领域,控制光波长的吸收,特别是生物传感器应用领域。
{"title":"First-principle study of strontium intercalation in bilayer graphene","authors":"O Farkad, R Takassa, F Elfatouaki, S Hassine, A El mouncharih, O Choukri, A Ouahdani, E A Ibnouelghazi, D Abouelaoualim","doi":"10.1007/s12043-024-02759-6","DOIUrl":"10.1007/s12043-024-02759-6","url":null,"abstract":"<div><p>Modifying electrical and optical properties in two-carbon materials is essential for electronic devices, energy storage and biosensor applications. We report a comparative study of the effect of systematically intercalated strontium atoms in AA- and AB-stacked bilayer graphene (BG) in the framework of density functional theory (DFT). The electronic band structures, the total and partial electronic density of states and the dielectric function are studied. We show that the intercalation of atoms can influence both electronic properties. Our results show that the Dirac cones, a signature of graphene, are translated into the conduction band. This property may be useful in band-gap tuning applications of nanodevices. The optical properties were calculated parallel and perpendicular to the graphene sheet under polarised electric fields. The calculated optical properties show that the intercalation of Sr in the AA- and AB-stacked BGs promotes IR absorption. The findings provide a basis for developing graphene intercalary compounds, which can be used in optoelectronics to control the absorption of light wavelengths and specifically in biosensor applications.</p></div>","PeriodicalId":743,"journal":{"name":"Pramana","volume":null,"pages":null},"PeriodicalIF":1.9,"publicationDate":"2024-08-23","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142204395","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"物理与天体物理","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2024-08-23DOI: 10.1007/s12043-024-02813-3
Nguyen Van Hong
Oxygen packing factor (OPF) and atomic-level structure characteristics of the germania system at high temperature and pressure were investigated based on molecular dynamics (MD) simulation. Data analytic techniques, including Monte Carlo method, machine learning and data mining, were used to gain insights from the simulation data. We focus on elucidating the correlation between structure and OPF under high pressure. The research results have established the relationship of the network structure, polyamorphism, liquid–liquid phase transformations and microphase separation with OPF. The research findings revealed promising possibilities in developing novel materials and their applications.
{"title":"Visualising the structure of liquid germanium dioxide under compression","authors":"Nguyen Van Hong","doi":"10.1007/s12043-024-02813-3","DOIUrl":"10.1007/s12043-024-02813-3","url":null,"abstract":"<div><p>Oxygen packing factor (OPF) and atomic-level structure characteristics of the germania system at high temperature and pressure were investigated based on molecular dynamics (MD) simulation. Data analytic techniques, including Monte Carlo method, machine learning and data mining, were used to gain insights from the simulation data. We focus on elucidating the correlation between structure and OPF under high pressure. The research results have established the relationship of the network structure, polyamorphism, liquid–liquid phase transformations and microphase separation with OPF. The research findings revealed promising possibilities in developing novel materials and their applications.\u0000</p></div>","PeriodicalId":743,"journal":{"name":"Pramana","volume":null,"pages":null},"PeriodicalIF":1.9,"publicationDate":"2024-08-23","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142204394","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"物理与天体物理","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}