Advanced Theory and Simulations最新文献

{"title":"Molecular Level Non-Covalent Interactions Between Celecoxib and Valdecoxib and Some Common Polar Solvents","authors":"Sneha Anna Sunny, Megha Joseph, Abdullah Yahya Abdullah Alzahrani, Ola A. Abu Ali, Samy F. Mahmoud, Renjith Thomas","doi":"10.1002/adts.202500281","DOIUrl":"https://doi.org/10.1002/adts.202500281","url":null,"abstract":"Celecoxib (CB) and Valdecoxib (VB) are two NSAIDs that belong to the category of anti-inflammatory drugs. They selectively inhibit the cyclooxygenase-2 enzyme and are hence used to treat several symptoms of rheumatoid and osteoarthritis. The current study focuses on investigating the interaction of these drugs with some randomly selected polar solvents explicitly. Using the M06-2x/aug-cc-pVDZ level of the theory of DFT, 12 complexes are optimized in the gas phase and their intermolecular interaction studies proceed. After the evaluation of binding energy, frontier molecular orbital analysis, and natural bond orbital analysis are carried out to get an idea of the charge localization and orbital behavior of complexes. Theoretical tools like an atom in molecule (AIM), reduced density gradient (NCI-RDG), independent gradient model based on Hirshfeld partition (IGMH), interaction region indicator (IRI), and core-valence bifurcation (CVB) index are used to identify the intermolecular interaction sites (hydrogen bond) and their strength. EDA analysis gave an idea of how the interaction energy is disseminated into various energy components. All the results obtained show that both drugs effectively interact with DMSO.","PeriodicalId":7219,"journal":{"name":"Advanced Theory and Simulations","volume":"7 1","pages":""},"PeriodicalIF":3.3,"publicationDate":"2025-04-24","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143866830","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}

{"title":"Composite Activation Belief Rule Base Model for Complex Systems Based on Multi-Dimensional Reduction","authors":"Jinting Shen, Zeyang Si, Wei He, Ning Ma, Hongyu Li","doi":"10.1002/adts.202500111","DOIUrl":"https://doi.org/10.1002/adts.202500111","url":null,"abstract":"As a model based on expert knowledge, belief rule base (BRB) is widely used in model construction of complex systems. However, due to the complexity and uncertainty of complex systems, a large number of rules are often generated when complex models are constructed using the initial BRB. This results in rule base expansion and diminished modeling capability. Therefore, a multi-dimensional rule evaluation framework is first developed in this study. The BRB is effectively screened and optimized, resulting in a significant reduction in the total number of rules and a decrease in model complexity. Furthermore, to ensure the completeness and accuracy of the simplified BRB, a composite rule activation method is introduced for model inference, and a novel evidential reasoning (ER) calculation procedure is designed. Ultimately, a projection covariance matrix adaptation evolution strategy (P-CMA-ES)-based optimization algorithm is proposed to improve the remaining parameters of the model. The optimal model structure is selected using the Akaike information criterion (AIC). In this paper, through case study, the implementation of this method is demonstrated, and the effectiveness of the model in practical applications is validated.","PeriodicalId":7219,"journal":{"name":"Advanced Theory and Simulations","volume":"8 1","pages":""},"PeriodicalIF":3.3,"publicationDate":"2025-04-24","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143872729","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}

{"title":"Nano- to Mm-Scale Fluid Dynamic Phenomena Induced by Plasmon-Assisted Photothermal Effect in Microfluidic Channels","authors":"Ying Du, Yifen Lian, Yuying Wang, Guangyu Qiu, Ming Zhang","doi":"10.1002/adts.202500374","DOIUrl":"https://doi.org/10.1002/adts.202500374","url":null,"abstract":"Photothermal effect induced by plasmonic nanostructures has been widely used for fluid manipulation and heat transport in lab-on-a-chip applications based on microfluidics. In this article, a comprehensive multiscale and multiparameter study is presented for a 3D gold nanoparticles (AuNPs) based optofluidic channel. Multiphysics simulations using finite element method (FEM), consisting of electromagnetic, thermal, and fluid flow fields are used to analyze both steady-state spatial distribution and transient evolutions of the thermally driven fluid dynamic phenomena in the microscopic field. This study demonstrates that a nano-scale thermal gradient can lead to nm-scale changes in fluid dynamics and on the nano-scale, while such convection does not significantly affect the steady-state temperature distribution, even in the presence of injection flow, but the localized thermal-driven convection will contribute to the flow dynamics to some extent. Given the millimetric size of the heat source in microfluidic system, convection exerts a powerful influence to control fluid motion and temperature gradient. Moreover, thanks to a comprehensive parameter study involving AuNPs temperature, channel height, and injection flow velocity, this work elucidates the role of pressure-driven flow and thermal-induced convection in controlling fluid and mass transport in microfluidic conditions, which will enhance the functionality of plasmofluidics for various bioapplications.","PeriodicalId":7219,"journal":{"name":"Advanced Theory and Simulations","volume":"35 1","pages":""},"PeriodicalIF":3.3,"publicationDate":"2025-04-23","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143862210","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}

{"title":"Optimized Design of Micro-TEC with Variable Cross-Section Structure","authors":"Gang Zhan, Dongwang Yang, Kechen Tang, Yutian Liu, Chenyang Li, Ziao Wang, Weiqiang Cao, Yonggao Yan, Xinfeng Tang","doi":"10.1002/adts.202401471","DOIUrl":"https://doi.org/10.1002/adts.202401471","url":null,"abstract":"The increasing heat flux in microelectronic device challenges traditional cooling methods. Thermoelectric coolers (TECs) offer effective hotspot management through direct integration with microelectronic components. However, their efficiency is limited by thermoelectric properties, resulting in high power consumption and additional thermal loads. This study introduces a 3D finite element model to optimize micro-TEC with variable cross-sections. Key parameters, including cross-sectional area ratio (<i>s</i>), packing density (<i>p</i>_d), leg center width (<i>w</i>), leg height (<i>l</i>), and external conditions (ambient temperature <i>T</i>_m, heat load <i>Q</i>_c) are systematically analyzed. At <i>T</i>_m = 90 °C and <i>Q</i>_c = 1 W, with <i>p</i>_d = 120 legs cm⁻², <i>l</i> = 0.5 mm and identical TE leg volume, the novel design reduces power consumption from 1.97 W in traditional designs to 1.56 W, a reduction of 20.8%. Further optimization achieved a minimum power consumption of 1.43 W at <i>T</i>_m = 90 °C, <i>Q</i>_c = 1 W, <i>p</i>_d = 528 legs cm⁻², <i>w</i> = 0.2 mm, <i>l</i> = 0.2 mm and <i>s</i> = 6.85. These findings provide a framework for reducing TEC power consumption and material costs, advancing efficient cooling in microelectronics.","PeriodicalId":7219,"journal":{"name":"Advanced Theory and Simulations","volume":"7 1","pages":""},"PeriodicalIF":3.3,"publicationDate":"2025-04-23","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143862126","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}

{"title":"Parametric Analysis of Organic LED and Photo-Diode Based Sensor for Heart Rate Detection","authors":"Sugandha Yadav, Poornima Mittal, Shubham Negi","doi":"10.1002/adts.202500037","DOIUrl":"https://doi.org/10.1002/adts.202500037","url":null,"abstract":"Conventional Light emitting diode and photo-diode integration is the best suitable combination for point-of-care diagnostic in the field of sensor applications. However, these approaches based on inorganic devices are not scalable to incorporate multiple bio-marker. As a solution, this work proposes the methodology for bio-medical application using organic LED (OLED) and photo-diode to make a highly efficient, ultra-flexible, and low-cost sensor. In this paper, a green charge generation based OLED and organic photo diode (OPD) are utilized for heart rate measurements. The methodology is basically based on the fluorescence emission where green light having wavelength of 497 nm falls on the blood cells. Furthermore, a different intensity wavelength is sensed by the photodiode. The proposed OLED exhibits current and luminescence parameters of 0.92 A and 8 363.6 cd m⁻², correspondingly. Moreover, the presented OPD demonstrates dark currents and photocurrent of 10.2 and 174.5 nA, subsequently. This proposed technique can be also investigated in terms of other biomedical applications such as oxygen sensor, cancer detection, corona detection etc.","PeriodicalId":7219,"journal":{"name":"Advanced Theory and Simulations","volume":"124 1","pages":""},"PeriodicalIF":3.3,"publicationDate":"2025-04-22","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143857744","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}

{"title":"Input Consistency Regularization of Experimental Data for Modeling Functional Characteristics of A2M3O12 Family of Compounds","authors":"Natalia V. Kireeva, Aslan Yu. Tsivadze","doi":"10.1002/adts.202500073","DOIUrl":"https://doi.org/10.1002/adts.202500073","url":null,"abstract":"The prediction confidence is one of the goals of any machine learning-based study with no respect if this is distinguished as the aim of the study or is the associated desired concomitant. The possibility do not import the additional error into the pre-experimental estimation of the studied characteristics should be the goal of machine learning-based approaches in any case limited in their accuracy by the precision and confidence of the experimental data. The representation theory and information geometry come to the fore to achieve the stated desiderates. In this study, the approaches related to the input consistency regularization are considered which may provide with the required enhancement in the prediction confidence and are able to recoup the part of the experimental error associated with obtaining the data using the methods of different precision or with the discrepancy in the results obtained. The methodology of regularization of the input data consistency is considered in this study in relation to the problem of the predictive modeling of the functional characteristics of &lt;span data-altimg=\"/cms/asset/bfc382f8-381b-45dd-ac55-fab8d0208d46/adts202500073-math-0003.png\"&gt;&lt;/span&gt;&lt;mjx-container ctxtmenu_counter=\"3\" ctxtmenu_oldtabindex=\"1\" jax=\"CHTML\" role=\"application\" sre-explorer- style=\"font-size: 103%; position: relative;\" tabindex=\"0\"&gt;&lt;mjx-math aria-hidden=\"true\" location=\"graphic/adts202500073-math-0003.png\"&gt;&lt;mjx-semantics&gt;&lt;mjx-mrow data-semantic-annotation=\"clearspeak:unit\" data-semantic-children=\"2,5,8\" data-semantic-content=\"9,10\" data-semantic- data-semantic-role=\"implicit\" data-semantic-speech=\"normal upper A 2 normal upper M 3 normal upper O 12\" data-semantic-type=\"infixop\"&gt;&lt;mjx-msub data-semantic-children=\"0,1\" data-semantic- data-semantic-parent=\"11\" data-semantic-role=\"latinletter\" data-semantic-type=\"subscript\"&gt;&lt;mjx-mi data-semantic-annotation=\"clearspeak:simple\" data-semantic-font=\"normal\" data-semantic- data-semantic-parent=\"2\" data-semantic-role=\"latinletter\" data-semantic-type=\"identifier\"&gt;&lt;mjx-c&gt;&lt;/mjx-c&gt;&lt;/mjx-mi&gt;&lt;mjx-script style=\"vertical-align: -0.15em;\"&gt;&lt;mjx-mn data-semantic-annotation=\"clearspeak:simple\" data-semantic-font=\"normal\" data-semantic- data-semantic-parent=\"2\" data-semantic-role=\"integer\" data-semantic-type=\"number\" size=\"s\"&gt;&lt;mjx-c&gt;&lt;/mjx-c&gt;&lt;/mjx-mn&gt;&lt;/mjx-script&gt;&lt;/mjx-msub&gt;&lt;mjx-mo data-semantic-added=\"true\" data-semantic- data-semantic-operator=\"infixop,⁢\" data-semantic-parent=\"11\" data-semantic-role=\"multiplication\" data-semantic-type=\"operator\" style=\"margin-left: 0.056em; margin-right: 0.056em;\"&gt;&lt;mjx-c&gt;&lt;/mjx-c&gt;&lt;/mjx-mo&gt;&lt;mjx-msub data-semantic-children=\"3,4\" data-semantic- data-semantic-parent=\"11\" data-semantic-role=\"latinletter\" data-semantic-type=\"subscript\"&gt;&lt;mjx-mi data-semantic-annotation=\"clearspeak:simple\" data-semantic-font=\"normal\" data-semantic- data-semantic-parent=\"5\" data-semantic-role=\"latinletter\" data-semantic-type=\"identifier\"&gt;&lt;mjx-c&gt;&lt;/mjx-c&gt;&lt;/mjx-mi&gt;&lt;mjx-script style=\"vertical-align: -0.1","PeriodicalId":7219,"journal":{"name":"Advanced Theory and Simulations","volume":"7 1","pages":""},"PeriodicalIF":3.3,"publicationDate":"2025-04-22","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143862127","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}

{"title":"Analysis of Non-Covalent Interactions Present within a Series of Nucleobase Dimers from the Perspective of Quantum Topology and Aromaticity","authors":"Swapnil Goswami, Aniruddha Ganguly","doi":"10.1002/adts.202500121","DOIUrl":"https://doi.org/10.1002/adts.202500121","url":null,"abstract":"“Atoms in Molecules” formalism is implemented to assess the non-covalent interactions present within a series of homo and heterodimers of the natural DNA nucleobases to critically analyze the characteristics and the energetics of the interaction lines. Furthermore, the Nucleus independent chemical shift (NICS) descriptor is employed to demarcate the role of aromaticity in dictating the specifics of the said non-covalent interactions as well as the overall spatial architectures. Although, the typical observation is that the N─H····N and the N─H····O hydrogen bonds (HB) are resonance assisted (partially covalent) and ionic respectively, deviation from this trend is also apparent. Moreover, it is found that the conventional notion of resonance assisted HBs in a dimeric structure consisting of aromatic skeletons (i.e., an increase in thearomaticity of the ring containing the HB donor moiety coupled with a concomitant decrease in the aromaticity of the ring containing the HB acceptor atom/group) is not strictly applicable to the nucleobases. The influence of steric factor in the stabilizations associated with the studied HBs is justified via Energy Decomposition Analysis. Finally, the analyses address the conundrum of whether the unnatural nucleobase 7-azaindole is really a good nucleobase mimic.","PeriodicalId":7219,"journal":{"name":"Advanced Theory and Simulations","volume":"12 1","pages":""},"PeriodicalIF":3.3,"publicationDate":"2025-04-22","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143862128","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}

{"title":"Optimizing Core Modifications for High‐Performance D‐A‐D Molecular Systems: a Multi‐Faceted Study on NLO Properties, Solvent Effects, Charge Transfer, and Photovoltaic Efficiency","authors":"Iqra Kaifi, Shabbir Muhammad, Shamsa Bibi, Shafiq urRehman, Abul Kalam, Aijaz Rasool Chaudhry, Saleh S. Alarfaji, Abdullah G. Al‐Sehemi","doi":"10.1002/adts.202500169","DOIUrl":"https://doi.org/10.1002/adts.202500169","url":null,"abstract":"Developing materials with strong nonlinear optical (NLO) response is crucial for advancing optoelectronic technologies. This study investigates the electro‐optical behavior of thiadiazole‐based derivatives (PAH‐P to PAH‐BTZ‐3), designed through central core modifications to enhance NLO performance. Quantum chemical calculations were conducted using density functional theory (DFT) with M06‐2X functional and 6‐311G** basis set. Among the studied compounds, PAH‐BTZ‐3 exhibited the highest third‐order NLO polarizability &lt;γ&gt; of 1294.7 × 10<jats:sup>−36</jats:sup> esu, which is ≈168 times greater than the benchmark molecule <jats:italic>para</jats:italic>‐nitroaniline (<jats:italic>p</jats:italic>‐NA). Solvent effects demonstrated using the Polarizable Continuum Model (PCM) and Conductor‐like Screening Model (COSMO) showed a ≈2 times increase in &lt;γ&gt; values compared to the gas phase. Frequency‐dependent analysis revealed maximum γ(−ω;ω,0,0) and γ(−2ω;ω,ω,0) values of 3673.8 × 10<jats:sup>−36</jats:sup> esu and 7076 × 10<jats:sup>−36</jats:sup> esu, for PAH‐BTZ‐3, highlighting resonance reabsorption. Frontier molecular orbital (FMO) analysis displayed a reduction in the crucial orbital energy gap from 5.80 eV to 3.74 eV. UV‐visible spectra confirmed strong intramolecular charge transfer, with a maximum red shift at 552 nm for PAH‐BTZ‐3. Photovoltaic parameters, like open‐circuit voltage ranges from 1.57 eV to 2.89 eV, indicate the potential of these compounds in solar energy applications.","PeriodicalId":7219,"journal":{"name":"Advanced Theory and Simulations","volume":"41 1","pages":""},"PeriodicalIF":3.3,"publicationDate":"2025-04-20","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143851092","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}

{"title":"Band Alignment and Defect Engineering in Barium‐Doped Cu2ZnSnSe4 Solar Cells: Implications for Device Performance","authors":"Neha Kumari, Jitendra Kumar","doi":"10.1002/adts.202500022","DOIUrl":"https://doi.org/10.1002/adts.202500022","url":null,"abstract":"Cu<jats:sub>2</jats:sub>ZnSnSe<jats:sub>4</jats:sub> (CZTSe)‐based photovoltaic devices have emerged as promising next‐generation technology, with recent power conversion efficiencies surpassing 13.8%. In this study, the effects of barium (Ba) incorporation and intrinsic defects on the performance of Cu<jats:sub>2</jats:sub>Ba<jats:italic><jats:sub>x</jats:sub></jats:italic>Zn<jats:sub>1‐</jats:sub><jats:italic><jats:sub>x</jats:sub></jats:italic>SnSe<jats:sub>4</jats:sub> (CBZTSe) photovoltaic devices are systematically explored. The interface band alignment at both the front and back contacts is analyzed by adjusting the electron affinity of CBZTSe through varying Ba content. Optimal conduction band offsets of 20 meV at the CBZTSe/CdS front interface and 40 meV at the MoSe<jats:sub>2</jats:sub>/CBZTSe back interface are observed for 50% Ba incorporation. The impact of intrinsic defects on device performance is also examined, with shallow defects like <jats:italic>V<jats:sub>Cu</jats:sub></jats:italic> and <jats:italic>Cu<jats:sub>Ba</jats:sub></jats:italic> showing minimal influence at low concentrations, while deep‐level and multivalent defects such as <jats:italic>Cu<jats:sub>i</jats:sub></jats:italic>, <jats:italic>Sn<jats:sub>Cu</jats:sub></jats:italic>, <jats:italic>Sn<jats:sub>i</jats:sub></jats:italic>, and <jats:italic>Se<jats:sub>i</jats:sub></jats:italic> significantly decreased efficiency due to enhanced charge carrier recombination. This study emphasizes the importance of band alignment and defect management in enhancing the performance of CBZTSe‐based PV devices and offers insights for improving their efficiency further.","PeriodicalId":7219,"journal":{"name":"Advanced Theory and Simulations","volume":"21 1","pages":""},"PeriodicalIF":3.3,"publicationDate":"2025-04-20","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143853313","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}

{"title":"Investigation of Electronic and Transport Properties of Zigzag Aluminium Nitride Nanoribbon for Magnetoresistive Devices using Selective Edge Chlorination","authors":"Banti Yadav, Pankaj Srivastava, Varun Sharma","doi":"10.1002/adts.202401276","DOIUrl":"https://doi.org/10.1002/adts.202401276","url":null,"abstract":"In this work, the utility of Zigzag Aluminium Nitride Nanoribbons (ZAlNNR) for voltage‐controlled magnetoresistive devices is investigated using the DFT‐NEGF approach. Based on energy calculations and magnetic moment analysis, it is proposed that selective edge chlorination of ZAlNNR leads to the magnetic ground state (AFM). To examine the impact of electrode magnetization on transport properties, the curve is calculated for parallel and antiparallel spin orientation of the electrodes. For parallel cases, spin‐filtering efficiency (SFE) is calculated, which is at various voltages, and also observe negative differential resistance (NDR) behavior. In the antiparallel case, it is observed that both finite transmission and zero transmission regions for variable bias voltage. Hence, an oscillatory current behavior is observed in this case. Finally, magnetoresistance (MR) is calculated in both spin‐up and spin‐down cases, which is of the order of at (for spin‐up configuration). Such large values of SFE and MR make it an appropriate choice for spin filter/voltage‐controlled magnetic tunnel junctions (MTJs).","PeriodicalId":7219,"journal":{"name":"Advanced Theory and Simulations","volume":"13 1","pages":""},"PeriodicalIF":3.3,"publicationDate":"2025-04-20","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"143853314","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}