Works matching IS 25130390 AND DT 2025 AND VI 8 AND IP 8

Results: 32

Issue Information (Adv. Theory Simul. 8/2025).

Published in:: Advanced Theory & Simulations, 2025, v. 8, n. 8, p. 1, doi. 10.1002/adts.202570016
Publication type:: Article

Genetic Algorithm to Obtain Accurate Force Constants in Graphene (Adv. Theory Simul. 8/2025).

Published in:

Advanced Theory & Simulations, 2025, v. 8, n. 8, p. 1, doi. 10.1002/adts.202570015

By:

Liu, Wenjing;
Xu, Jinrong;
Gong, Shulei;
Huang, Wenrui;
Hao, Jiahui;
Yu, Jiangying;
Huang, Kai;
Wang, Ying

Publication type:

Article

Nano‐ to Mm‐Scale Fluid Dynamic Phenomena Induced by Plasmon‐Assisted Photothermal Effect in Microfluidic Channels.

Published in:

Advanced Theory & Simulations, 2025, v. 8, n. 8, p. 1, doi. 10.1002/adts.202500374

By:

Du, Ying;
Lian, Yifen;
Wang, Yuying;
Qiu, Guangyu;
Zhang, Ming

Publication type:

Article

Modeling the Diffusion Coefficient of Charge Carriers in Metal Ion Batteries using the Randles‐Sevcik Equation.

Published in:

Advanced Theory & Simulations, 2025, v. 8, n. 8, p. 1, doi. 10.1002/adts.202500346

By:

El‐Latif, Eman I. Abd;
Kebede, Mesfin Abayneh;
Sekar, Karthick;
Hameed, Talaat A.;
Yahia, Ibrahim S.;
Gao, Hongcai;
Sheha, Eslam

Publication type:

Article

Advanced Computational Study on 144 Combinations of ETL & HTL Layers for High‐Performance Cs₂TeI₆ Solar Cells.

Published in:

Advanced Theory & Simulations, 2025, v. 8, n. 8, p. 1, doi. 10.1002/adts.202500341

By:

Raj, Manasvi;
Raj, Aryan;
Kishor, Aditya;
Kushwaha, Aditya;
Goel, Neeraj

Publication type:

Article

Molecular Level Non‐Covalent Interactions Between Celecoxib and Valdecoxib and Some Common Polar Solvents.

Published in:

Advanced Theory & Simulations, 2025, v. 8, n. 8, p. 1, doi. 10.1002/adts.202500281

By:

Sunny, Sneha Anna;
Joseph, Megha;
Alzahrani, Abdullah Yahya Abdullah;
Ali, Ola A. Abu;
Mahmoud, Samy F.;
Thomas, Renjith

Publication type:

Article

Shifting the Selectivity of Perethylated Pillar[5]arene through Functionalization toward the Separation of Isomers of Ethyltoluene – A DFT and Molecular Dynamics Study.

Published in:

Advanced Theory & Simulations, 2025, v. 8, n. 8, p. 1, doi. 10.1002/adts.202500277

By:

Sushima M, Sam;
Vijay Solomon, Rajadurai

Publication type:

Article

Modeling n‐Type GaAs/AlGaAs Double Quantum Well Properties with Schrödinger‐Poisson Equations.

Published in:

Advanced Theory & Simulations, 2025, v. 8, n. 8, p. 1, doi. 10.1002/adts.202500227

By:

Jaouane, M.;
Ed‐Dahmouny, A.;
Althib, H. M.;
Arraoui, R.;
Fakkahi, A.;
Azmi, H.;
El‐Bakkari, K.;
El‐Ghazi, H.;
Saadaoui, S.;
Sali, A.

Publication type:

Article

Thermoelectric and Optical Properties of HfSi2N4 and HfGe2N4: A First‐Principles Investigation.

Published in:

Advanced Theory & Simulations, 2025, v. 8, n. 8, p. 1, doi. 10.1002/adts.202500223

By:

Das, Chayan;
Abhishek;
Saikia, Dibyajyoti;
Gandi, Appala Naidu;
Sahu, Satyajit

Publication type:

Article

Tuning of Optoelectronic Properties of Chalcohalides by Tailoring Pnictogen Composition for Sustainable Photovoltaics.

Published in:

Advanced Theory & Simulations, 2025, v. 8, n. 8, p. 1, doi. 10.1002/adts.202500104

By:

Thakshila Jayawardane, Jayawardane Thambugalage Sanjeewani;
Hu, Dengwei;
Abeygunawardhana, Pradeep K. W.;
Asha, Galhenage

Publication type:

Article

NIR to UV Frequency Conversion Based on Polarization‐Sensitive BIC Excitation in Si‐Metasurface.

Published in:

Advanced Theory & Simulations, 2025, v. 8, n. 8, p. 1, doi. 10.1002/adts.202500094

By:

Momeni, Fateme;
Ahmadi, Vahid

Publication type:

Article

Genetic Algorithm to Obtain Accurate Force Constants in Graphene.

Published in:

Advanced Theory & Simulations, 2025, v. 8, n. 8, p. 1, doi. 10.1002/adts.202500124

By:

Liu, Wenjing;
Xu, Jinrong;
Gong, Shulei;
Huang, Wenrui;
Hao, Jiahui;
Yu, Jiangying;
Huang, Kai;
Wang, Ying

Publication type:

Article

Analysis of Non‐Covalent Interactions Present within a Series of Nucleobase Dimers from the Perspective of Quantum Topology and Aromaticity.

Published in:

Advanced Theory & Simulations, 2025, v. 8, n. 8, p. 1, doi. 10.1002/adts.202500121

By:

Goswami, Swapnil;
Ganguly, Aniruddha

Publication type:

Article

Composite Activation Belief Rule Base Model for Complex Systems Based on Multi‐Dimensional Reduction.

Published in:

Advanced Theory & Simulations, 2025, v. 8, n. 8, p. 1, doi. 10.1002/adts.202500111

By:

Shen, Jinting;
Si, Zeyang;
He, Wei;
Ma, Ning;
Li, Hongyu

Publication type:

Article

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.

Published in:

Advanced Theory & Simulations, 2025, v. 8, n. 8, p. 1, doi. 10.1002/adts.202500169

By:

Kaifi, Iqra;
Muhammad, Shabbir;
Bibi, Shamsa;
urRehman, Shafiq;
Kalam, Abul;
Chaudhry, Aijaz Rasool;
Alarfaji, Saleh S.;
Al‐Sehemi, Abdullah G.

Publication type:

Article

Theoretical Exploration of Si7X (X = Ge, Sn): Bridging Structural and Energy‐Related Applications.

Published in:

Advanced Theory & Simulations, 2025, v. 8, n. 8, p. 1, doi. 10.1002/adts.202500136

By:

Bougherara, Kada;
Bouhlal, Abdelkader;
Goumri‐Said, Souraya;
Kanoun, Mohammed Benali

Publication type:

Article

First Principles Calculations of Structural, Phonon, Mechanical, Optoelectronic, Photovoltaic, Thermoelectric and Thermodynamic Properties of Inorganic Novel Cubic Halide Perovskites Ca3AsX3 (X = Br, I) a DFT Study.

Published in:

Advanced Theory & Simulations, 2025, v. 8, n. 8, p. 1, doi. 10.1002/adts.202500087

By:

Kmichou, M.;
Masrour, Rachid

Publication type:

Article

Input Consistency Regularization of Experimental Data for Modeling Functional Characteristics of A2M3O12 Family of Compounds.

Published in:

Advanced Theory & Simulations, 2025, v. 8, n. 8, p. 1, doi. 10.1002/adts.202500073

By:

Kireeva, Natalia V.;
Tsivadze, Aslan Yu.

Publication type:

Article

FMint: Bridging Human Designed and Data Pretrained Models for Differential Equation Foundation Model for Dynamical Simulation.

Published in:

Advanced Theory & Simulations, 2025, v. 8, n. 8, p. 1, doi. 10.1002/adts.202500062

By:

Song, Zezheng;
Yuan, Jiaxin;
Yang, Haizhao

Publication type:

Article

Parametric Analysis of Organic LED and Photo‐Diode Based Sensor for Heart Rate Detection.

Published in:

Advanced Theory & Simulations, 2025, v. 8, n. 8, p. 1, doi. 10.1002/adts.202500037

By:

Yadav, Sugandha;
Mittal, Poornima;
Negi, Shubham

Publication type:

Article

Band Alignment and Defect Engineering in Barium‐Doped Cu2ZnSnSe4 Solar Cells: Implications for Device Performance.

Published in:

Advanced Theory & Simulations, 2025, v. 8, n. 8, p. 1, doi. 10.1002/adts.202500022

By:

Kumari, Neha;
Kumar, Jitendra

Publication type:

Article

Theoretical Studies on the Structure and Properties of Bisubstituted Derivatives of Curcumin.

Published in:

Advanced Theory & Simulations, 2025, v. 8, n. 8, p. 1, doi. 10.1002/adts.202500009

By:

Tian, Buwei;
Li, Xiaoyu;
Zhang, Min

Publication type:

Article

FEM‐Assisted Deep Learning for Object Recognition in Wearable Smart Gloves.

Published in:

Advanced Theory & Simulations, 2025, v. 8, n. 8, p. 1, doi. 10.1002/adts.202401551

By:

Zhang, Yan;
Newton, Md All Amin;
Xie, Hong;
Lake, Mark J.

Publication type:

Article

Can Pb‐Free Halide Perovskites be Realized by Incorporating the Neutral or Anionic Molecule?

Published in:

Advanced Theory & Simulations, 2025, v. 8, n. 8, p. 1, doi. 10.1002/adts.202401546

By:

Hu, Yuanmao;
Zhao, Shuai;
Chen, Lin

Publication type:

Article

Novel Estimation of Nanofiber Diameter from SEM Images Using Deep Feature Embeddings and Machine Learning Models.

Published in:

Advanced Theory & Simulations, 2025, v. 8, n. 8, p. 1, doi. 10.1002/adts.202401489

By:

Priyanto, Aan;
Listari, Eka Sentia Ayu;
Maisa, Kamilah Nada;
Hapidin, Dian Ahmad;
Khairurrijal, Khairurrijal

Publication type:

Article

Optimized Design of Micro‐TEC with Variable Cross‐Section Structure.

Published in:

Advanced Theory & Simulations, 2025, v. 8, n. 8, p. 1, doi. 10.1002/adts.202401471

By:

Zhan, Gang;
Yang, Dongwang;
Tang, Kechen;
Liu, Yutian;
Li, Chenyang;
Wang, Ziao;
Cao, Weiqiang;
Yan, Yonggao;
Tang, Xinfeng

Publication type:

Article

Exploration of New 212 MAX Phases: M2AB2 (M = Mo, Ta; A = Ga, Ge) via DFT Calculations.

Published in:

Advanced Theory & Simulations, 2025, v. 8, n. 8, p. 1, doi. 10.1002/adts.202401448

By:

Ishtiaq, A. K. M. Naim;
Uddin, Md. Nasir;
Rana, Md. Rasel;
Islam, Shariful;
Afsary, Noor;
Hoque, Karimul;
Ali, Md. Ashraf

Publication type:

Article

Electronic and Magnetic Properties of Ga, As/Br and Partial‐Hydrogenation Doped Stanene: First‐Principles Calculations.

Published in:

Advanced Theory & Simulations, 2025, v. 8, n. 8, p. 1, doi. 10.1002/adts.202401396

By:

Annan‐Noonoo, Emmanuel;
Peprah, David K.;
Martin, Henry;
Labik, Linus K.;
Donkor, Michael E. K.;
Britwum, Akyana;
Yaya, Abu;
Elloh, Van W.;
Abavare, Eric K. K.

Publication type:

Article

First‐Principles Study on the Effect of Trace Elements on the Diffusion of C Atoms in Fe‐Si Alloy.

Published in:

Advanced Theory & Simulations, 2025, v. 8, n. 8, p. 1, doi. 10.1002/adts.202401327

By:

Li, Cunwang;
Cai, Haibin;
Ding, Cuijiao;
Su, Fuyong

Publication type:

Article

Investigation of Electronic and Transport Properties of Zigzag Aluminium Nitride Nanoribbon for Magnetoresistive Devices using Selective Edge Chlorination.

Published in:

Advanced Theory & Simulations, 2025, v. 8, n. 8, p. 1, doi. 10.1002/adts.202401276

By:

Yadav, Banti;
Srivastava, Pankaj;
Sharma, Varun

Publication type:

Article

Numerical Simulation and Experimental Verification of Mechanical Displacements in Piezoelectric Transformer.

Published in:

Advanced Theory & Simulations, 2025, v. 8, n. 8, p. 1, doi. 10.1002/adts.202401232

By:

Boukazouha, Faiza;
Poulin‐Vittrant, Guylaine;
Rguiti, Mohamed;
Lethiecq, Marc

Publication type:

Article

Multi‐Phase Field Model of Laser Powder Bed Fusion Based Additive Manufacturing of IN718 Superalloy.

Published in:

Advanced Theory & Simulations, 2025, v. 8, n. 8, p. 1, doi. 10.1002/adts.202401031

By:

Kumar, Shakti;
Mukherjee, Indrani;
Chandu, K. Pavan;
Das, Prosenjit

Publication type:

Article

Works matching IS 25130390 AND DT 2025 AND VI 8 AND IP 8

Issue Information (Adv. Theory Simul. 8/2025).

Genetic Algorithm to Obtain Accurate Force Constants in Graphene (Adv. Theory Simul. 8/2025).

Nano‐ to Mm‐Scale Fluid Dynamic Phenomena Induced by Plasmon‐Assisted Photothermal Effect in Microfluidic Channels.

Modeling the Diffusion Coefficient of Charge Carriers in Metal Ion Batteries using the Randles‐Sevcik Equation.

Advanced Computational Study on 144 Combinations of ETL & HTL Layers for High‐Performance Cs₂TeI₆ Solar Cells.

Molecular Level Non‐Covalent Interactions Between Celecoxib and Valdecoxib and Some Common Polar Solvents.

Shifting the Selectivity of Perethylated Pillar[5]arene through Functionalization toward the Separation of Isomers of Ethyltoluene – A DFT and Molecular Dynamics Study.

Modeling n‐Type GaAs/AlGaAs Double Quantum Well Properties with Schrödinger‐Poisson Equations.

Thermoelectric and Optical Properties of HfSi<sub>2</sub>N<sub>4</sub> and HfGe<sub>2</sub>N<sub>4</sub>: A First‐Principles Investigation.

Tuning of Optoelectronic Properties of Chalcohalides by Tailoring Pnictogen Composition for Sustainable Photovoltaics.

NIR to UV Frequency Conversion Based on Polarization‐Sensitive BIC Excitation in Si‐Metasurface.

Genetic Algorithm to Obtain Accurate Force Constants in Graphene.

Analysis of Non‐Covalent Interactions Present within a Series of Nucleobase Dimers from the Perspective of Quantum Topology and Aromaticity.

Composite Activation Belief Rule Base Model for Complex Systems Based on Multi‐Dimensional Reduction.

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.

Theoretical Exploration of Si<sub>7</sub>X (X = Ge, Sn): Bridging Structural and Energy‐Related Applications.

First Principles Calculations of Structural, Phonon, Mechanical, Optoelectronic, Photovoltaic, Thermoelectric and Thermodynamic Properties of Inorganic Novel Cubic Halide Perovskites Ca<sub>3</sub>AsX<sub>3</sub> (X = Br, I) a DFT Study.

Input Consistency Regularization of Experimental Data for Modeling Functional Characteristics of A2M3O12 Family of Compounds.

FMint: Bridging Human Designed and Data Pretrained Models for Differential Equation Foundation Model for Dynamical Simulation.

Parametric Analysis of Organic LED and Photo‐Diode Based Sensor for Heart Rate Detection.

Band Alignment and Defect Engineering in Barium‐Doped Cu<sub>2</sub>ZnSnSe<sub>4</sub> Solar Cells: Implications for Device Performance.

Theoretical Studies on the Structure and Properties of Bisubstituted Derivatives of Curcumin.

FEM‐Assisted Deep Learning for Object Recognition in Wearable Smart Gloves.

Can Pb‐Free Halide Perovskites be Realized by Incorporating the Neutral or Anionic Molecule?

Novel Estimation of Nanofiber Diameter from SEM Images Using Deep Feature Embeddings and Machine Learning Models.

Optimized Design of Micro‐TEC with Variable Cross‐Section Structure.

Exploration of New 212 MAX Phases: M<sub>2</sub>AB<sub>2</sub> (M = Mo, Ta; A = Ga, Ge) via DFT Calculations.

Electronic and Magnetic Properties of Ga, As/Br and Partial‐Hydrogenation Doped Stanene: First‐Principles Calculations.

First‐Principles Study on the Effect of Trace Elements on the Diffusion of C Atoms in Fe‐Si Alloy.

Investigation of Electronic and Transport Properties of Zigzag Aluminium Nitride Nanoribbon for Magnetoresistive Devices using Selective Edge Chlorination.

Numerical Simulation and Experimental Verification of Mechanical Displacements in Piezoelectric Transformer.

Multi‐Phase Field Model of Laser Powder Bed Fusion Based Additive Manufacturing of IN718 Superalloy.