@article{ZhuangHuangLiangetal., author = {Zhuang, Xiaoying and Huang, Runqiu and Liang, Chao and Rabczuk, Timon}, title = {A coupled thermo-hydro-mechanical model of jointed hard rock for compressed air energy storage}, series = {Mathematical Problems in Engineering}, journal = {Mathematical Problems in Engineering}, doi = {10.1155/2014/179169}, url = {http://nbn-resolving.de/urn:nbn:de:gbv:wim2-20170428-31726}, abstract = {Renewable energy resources such as wind and solar are intermittent, which causes instability when being connected to utility grid of electricity. Compressed air energy storage (CAES) provides an economic and technical viable solution to this problem by utilizing subsurface rock cavern to store the electricity generated by renewable energy in the form of compressed air. Though CAES has been used for over three decades, it is only restricted to salt rock or aquifers for air tightness reason. In this paper, the technical feasibility of utilizing hard rock for CAES is investigated by using a coupled thermo-hydro-mechanical (THM) modelling of nonisothermal gas flow. Governing equations are derived from the rules of energy balance, mass balance, and static equilibrium. Cyclic volumetric mass source and heat source models are applied to simulate the gas injection and production. Evaluation is carried out for intact rock and rock with discrete crack, respectively. In both cases, the heat and pressure losses using air mass control and supplementary air injection are compared.}, subject = {Energiespeicherung}, language = {en} } @article{ZhangRen, author = {Zhang, Yongzheng and Ren, Huilong}, title = {Implicit implementation of the nonlocal operator method: an open source code}, series = {Engineering with computers}, volume = {2022}, journal = {Engineering with computers}, publisher = {Springer}, address = {London}, doi = {10.1007/s00366-021-01537-x}, url = {http://nbn-resolving.de/urn:nbn:de:gbv:wim2-20220216-45930}, pages = {1 -- 35}, abstract = {In this paper, we present an open-source code for the first-order and higher-order nonlocal operator method (NOM) including a detailed description of the implementation. The NOM is based on so-called support, dual-support, nonlocal operators, and an operate energy functional ensuring stability. The nonlocal operator is a generalization of the conventional differential operators. Combined with the method of weighed residuals and variational principles, NOM establishes the residual and tangent stiffness matrix of operate energy functional through some simple matrix without the need of shape functions as in other classical computational methods such as FEM. NOM only requires the definition of the energy drastically simplifying its implementation. The implementation in this paper is focused on linear elastic solids for sake of conciseness through the NOM can handle more complex nonlinear problems. The NOM can be very flexible and efficient to solve partial differential equations (PDEs), it's also quite easy for readers to use the NOM and extend it to solve other complicated physical phenomena described by one or a set of PDEs. Finally, we present some classical benchmark problems including the classical cantilever beam and plate-with-a-hole problem, and we also make an extension of this method to solve complicated problems including phase-field fracture modeling and gradient elasticity material.}, subject = {Strukturmechanik}, language = {en} } @article{Zhang, author = {Zhang, Yongzheng}, title = {Nonlocal dynamic Kirchhoff plate formulation based on nonlocal operator method}, series = {Engineering with Computers}, volume = {2022}, journal = {Engineering with Computers}, publisher = {Springer}, address = {London}, doi = {10.1007/s00366-021-01587-1}, url = {http://nbn-resolving.de/urn:nbn:de:gbv:wim2-20220209-45849}, pages = {1 -- 35}, abstract = {In this study, we propose a nonlocal operator method (NOM) for the dynamic analysis of (thin) Kirchhoff plates. The nonlocal Hessian operator is derived based on a second-order Taylor series expansion. The NOM does not require any shape functions and associated derivatives as 'classical' approaches such as FEM, drastically facilitating the implementation. Furthermore, NOM is higher order continuous, which is exploited for thin plate analysis that requires C1 continuity. The nonlocal dynamic governing formulation and operator energy functional for Kirchhoff plates are derived from a variational principle. The Verlet-velocity algorithm is used for the time discretization. After confirming the accuracy of the nonlocal Hessian operator, several numerical examples are simulated by the nonlocal dynamic Kirchhoff plate formulation.}, subject = {Angewandte Mathematik}, language = {en} } @article{ZhangHaoWangetal., author = {Zhang, Chao and Hao, Xiao-Li and Wang, Cuixia and Wei, Ning and Rabczuk, Timon}, title = {Thermal conductivity of graphene nanoribbons under shear deformation: A molecular dynamics simulation}, series = {Scientific Reports}, journal = {Scientific Reports}, doi = {10.1038/srep41398}, url = {http://nbn-resolving.de/urn:nbn:de:gbv:wim2-20170428-31718}, abstract = {Tensile strain and compress strain can greatly affect the thermal conductivity of graphene nanoribbons (GNRs). However, the effect of GNRs under shear strain, which is also one of the main strain effect, has not been studied systematically yet. In this work, we employ reverse nonequilibrium molecular dynamics (RNEMD) to the systematical study of the thermal conductivity of GNRs (with model size of 4 nm × 15 nm) under the shear strain. Our studies show that the thermal conductivity of GNRs is not sensitive to the shear strain, and the thermal conductivity decreases only 12-16\% before the pristine structure is broken. Furthermore, the phonon frequency and the change of the micro-structure of GNRs, such as band angel and bond length, are analyzed to explore the tendency of thermal conductivity. The results show that the main influence of shear strain is on the in-plane phonon density of states (PDOS), whose G band (higher frequency peaks) moved to the low frequency, thus the thermal conductivity is decreased. The unique thermal properties of GNRs under shear strains suggest their great potentials for graphene nanodevices and great potentials in the thermal managements and thermoelectric applications.}, subject = {W{\"a}rmeleitf{\"a}higkeit}, language = {en} } @article{VuBacNguyenXuanChenetal., author = {Vu-Bac, N. and Nguyen-Xuan, Hung and Chen, Lei and Lee, C.K. and Zi, Goangseup and Zhuang, Xiaoying and Liu, G.R. and Rabczuk, Timon}, title = {A phantom-node method with edge-based strain smoothing for linear elastic fracture mechanics}, series = {Journal of Applied Mathematics}, journal = {Journal of Applied Mathematics}, doi = {10.1155/2013/978026}, url = {http://nbn-resolving.de/urn:nbn:de:gbv:wim2-20170426-31676}, abstract = {This paper presents a novel numerical procedure based on the combination of an edge-based smoothed finite element (ES-FEM) with a phantom-node method for 2D linear elastic fracture mechanics. In the standard phantom-node method, the cracks are formulated by adding phantom nodes, and the cracked element is replaced by two new superimposed elements. This approach is quite simple to implement into existing explicit finite element programs. The shape functions associated with discontinuous elements are similar to those of the standard finite elements, which leads to certain simplification with implementing in the existing codes. The phantom-node method allows modeling discontinuities at an arbitrary location in the mesh. The ES-FEM model owns a close-to-exact stiffness that is much softer than lower-order finite element methods (FEM). Taking advantage of both the ES-FEM and the phantom-node method, we introduce an edge-based strain smoothing technique for the phantom-node method. Numerical results show that the proposed method achieves high accuracy compared with the extended finite element method (XFEM) and other reference solutions.}, subject = {Finite-Elemente-Methode}, language = {en} } @article{TalebiZiSilanietal., author = {Talebi, Hossein and Zi, Goangseup and Silani, Mohammad and Samaniego, Esteban and Rabczuk, Timon}, title = {A simple circular cell method for multilevel finite element analysis}, series = {Journal of Applied Mathematics}, journal = {Journal of Applied Mathematics}, doi = {10.1155/2012/526846}, url = {http://nbn-resolving.de/urn:nbn:de:gbv:wim2-20170426-31639}, abstract = {A simple multiscale analysis framework for heterogeneous solids based on a computational homogenization technique is presented. The macroscopic strain is linked kinematically to the boundary displacement of a circular or spherical representative volume which contains the microscopic information of the material. The macroscopic stress is obtained from the energy principle between the macroscopic scale and the microscopic scale. This new method is applied to several standard examples to show its accuracy and consistency of the method proposed.}, subject = {Finite-Elemente-Methode}, language = {en} } @article{ShiraziMohebbiAzadiKakavandetal., author = {Shirazi, A. H. N. and Mohebbi, Farzad and Azadi Kakavand, M. R. and He, B. and Rabczuk, Timon}, title = {Paraffin Nanocomposites for Heat Management of Lithium-Ion Batteries: A Computational Investigation}, series = {JOURNAL OF NANOMATERIALS}, journal = {JOURNAL OF NANOMATERIALS}, doi = {10.1155/2016/2131946}, url = {http://nbn-resolving.de/urn:nbn:de:gbv:wim2-20170411-31141}, abstract = {Lithium-ion (Li-ion) batteries are currently considered as vital components for advances in mobile technologies such as those in communications and transport. Nonetheless, Li-ion batteries suffer from temperature rises which sometimes lead to operational damages or may even cause fire. An appropriate solution to control the temperature changes during the operation of Li-ion batteries is to embed batteries inside a paraffin matrix to absorb and dissipate heat. In the present work, we aimed to investigate the possibility of making paraffin nanocomposites for better heat management of a Li-ion battery pack. To fulfill this aim, heat generation during a battery charging/discharging cycles was simulated using Newman's well established electrochemical pseudo-2D model. We couple this model to a 3D heat transfer model to predict the temperature evolution during the battery operation. In the later model, we considered different paraffin nanocomposites structures made by the addition of graphene, carbon nanotubes, and fullerene by assuming the same thermal conductivity for all fillers. This way, our results mainly correlate with the geometry of the fillers. Our results assess the degree of enhancement in heat dissipation of Li-ion batteries through the use of paraffin nanocomposites. Our results may be used as a guide for experimental set-ups to improve the heat management of Li-ion batteries.}, subject = {Batterie}, language = {en} } @article{ShamshirbandJoloudariGhasemiGoletal., author = {Shamshirband, Shahaboddin and Joloudari, Javad Hassannataj and GhasemiGol, Mohammad and Saadatfar, Hamid and Mosavi, Amir and Nabipour, Narjes}, title = {FCS-MBFLEACH: Designing an Energy-Aware Fault Detection System for Mobile Wireless Sensor Networks}, series = {Mathematics}, volume = {2020}, journal = {Mathematics}, number = {Volume 8, Issue 1, article 28}, publisher = {MDPI}, doi = {10.3390/math8010028}, url = {http://nbn-resolving.de/urn:nbn:de:gbv:wim2-20200107-40541}, pages = {24}, abstract = {Wireless sensor networks (WSNs) include large-scale sensor nodes that are densely distributed over a geographical region that is completely randomized for monitoring, identifying, and analyzing physical events. The crucial challenge in wireless sensor networks is the very high dependence of the sensor nodes on limited battery power to exchange information wirelessly as well as the non-rechargeable battery of the wireless sensor nodes, which makes the management and monitoring of these nodes in terms of abnormal changes very difficult. These anomalies appear under faults, including hardware, software, anomalies, and attacks by raiders, all of which affect the comprehensiveness of the data collected by wireless sensor networks. Hence, a crucial contraption should be taken to detect the early faults in the network, despite the limitations of the sensor nodes. Machine learning methods include solutions that can be used to detect the sensor node faults in the network. The purpose of this study is to use several classification methods to compute the fault detection accuracy with different densities under two scenarios in regions of interest such as MB-FLEACH, one-class support vector machine (SVM), fuzzy one-class, or a combination of SVM and FCS-MBFLEACH methods. It should be noted that in the study so far, no super cluster head (SCH) selection has been performed to detect node faults in the network. The simulation outcomes demonstrate that the FCS-MBFLEACH method has the best performance in terms of the accuracy of fault detection, false-positive rate (FPR), average remaining energy, and network lifetime compared to other classification methods.}, subject = {Vernetzung}, language = {en} } @article{ShamshirbandBabanezhadMosavietal., author = {Shamshirband, Shahaboddin and Babanezhad, Meisam and Mosavi, Amir and Nabipour, Narjes and Hajnal, Eva and Nadai, Laszlo and Chau, Kwok-Wing}, title = {Prediction of flow characteristics in the bubble column reactor by the artificial pheromone-based communication of biological ants}, series = {Engineering Applications of Computational Fluid Mechanics}, volume = {2020}, journal = {Engineering Applications of Computational Fluid Mechanics}, number = {volume 14, issue 1}, publisher = {Taylor \& Francis}, doi = {10.1080/19942060.2020.1715842}, url = {http://nbn-resolving.de/urn:nbn:de:gbv:wim2-20200227-41013}, pages = {367 -- 378}, abstract = {A novel combination of the ant colony optimization algorithm (ACO)and computational fluid dynamics (CFD) data is proposed for modeling the multiphase chemical reactors. The proposed intelligent model presents a probabilistic computational strategy for predicting various levels of three-dimensional bubble column reactor (BCR) flow. The results prove an enhanced communication between ant colony prediction and CFD data in different sections of the BCR.}, subject = {Maschinelles Lernen}, language = {en} } @article{ShabaniSamadianfardSattarietal., author = {Shabani, Sevda and Samadianfard, Saeed and Sattari, Mohammad Taghi and Mosavi, Amir and Shamshirband, Shahaboddin and Kmet, Tibor and V{\´a}rkonyi-K{\´o}czy, Annam{\´a}ria R.}, title = {Modeling Pan Evaporation Using Gaussian Process Regression K-Nearest Neighbors Random Forest and Support Vector Machines; Comparative Analysis}, series = {Atmosphere}, volume = {2020}, journal = {Atmosphere}, number = {Volume 11, Issue 1, 66}, doi = {10.3390/atmos11010066}, url = {http://nbn-resolving.de/urn:nbn:de:gbv:wim2-20200110-40561}, pages = {17}, abstract = {Evaporation is a very important process; it is one of the most critical factors in agricultural, hydrological, and meteorological studies. Due to the interactions of multiple climatic factors, evaporation is considered as a complex and nonlinear phenomenon to model. Thus, machine learning methods have gained popularity in this realm. In the present study, four machine learning methods of Gaussian Process Regression (GPR), K-Nearest Neighbors (KNN), Random Forest (RF) and Support Vector Regression (SVR) were used to predict the pan evaporation (PE). Meteorological data including PE, temperature (T), relative humidity (RH), wind speed (W), and sunny hours (S) collected from 2011 through 2017. The accuracy of the studied methods was determined using the statistical indices of Root Mean Squared Error (RMSE), correlation coefficient (R) and Mean Absolute Error (MAE). Furthermore, the Taylor charts utilized for evaluating the accuracy of the mentioned models. The results of this study showed that at Gonbad-e Kavus, Gorgan and Bandar Torkman stations, GPR with RMSE of 1.521 mm/day, 1.244 mm/day, and 1.254 mm/day, KNN with RMSE of 1.991 mm/day, 1.775 mm/day, and 1.577 mm/day, RF with RMSE of 1.614 mm/day, 1.337 mm/day, and 1.316 mm/day, and SVR with RMSE of 1.55 mm/day, 1.262 mm/day, and 1.275 mm/day had more appropriate performances in estimating PE values. It was found that GPR for Gonbad-e Kavus Station with input parameters of T, W and S and GPR for Gorgan and Bandar Torkmen stations with input parameters of T, RH, W and S had the most accurate predictions and were proposed for precise estimation of PE. The findings of the current study indicated that the PE values may be accurately estimated with few easily measured meteorological parameters.}, subject = {Maschinelles Lernen}, language = {en} } @article{SchmidtLahmer, author = {Schmidt, Albrecht and Lahmer, Tom}, title = {Efficient domain decomposition based reliability analysis for polymorphic uncertain material parameters}, series = {Proceedings in Applied Mathematics \& Mechanics}, volume = {2021}, journal = {Proceedings in Applied Mathematics \& Mechanics}, number = {Volume 21, issue 1}, publisher = {Wiley-VHC}, address = {Weinheim}, doi = {10.1002/pamm.202100014}, url = {http://nbn-resolving.de/urn:nbn:de:gbv:wim2-20220112-45563}, pages = {1 -- 4}, abstract = {Realistic uncertainty description incorporating aleatoric and epistemic uncertainties can be described within the framework of polymorphic uncertainty, which is computationally demanding. Utilizing a domain decomposition approach for random field based uncertainty models the proposed level-based sampling method can reduce these computational costs significantly and shows good agreement with a standard sampling technique. While 2-level configurations tend to get unstable with decreasing sampling density 3-level setups show encouraging results for the investigated reliability analysis of a structural unit square.}, subject = {Polymorphie}, language = {en} } @article{SaqlaiGhaniKhanetal., author = {Saqlai, Syed Muhammad and Ghani, Anwar and Khan, Imran and Ahmed Khan Ghayyur, Shahbaz and Shamshirband, Shahaboddin and Nabipour, Narjes and Shokri, Manouchehr}, title = {Image Analysis Using Human Body Geometry and Size Proportion Science for Action Classification}, series = {Applied Sciences}, volume = {2020}, journal = {Applied Sciences}, number = {volume 10, issue 16, article 5453}, publisher = {MDPI}, address = {Basel}, doi = {10.3390/app10165453}, url = {http://nbn-resolving.de/urn:nbn:de:gbv:wim2-20200904-42322}, pages = {24}, abstract = {Gestures are one of the basic modes of human communication and are usually used to represent different actions. Automatic recognition of these actions forms the basis for solving more complex problems like human behavior analysis, video surveillance, event detection, and sign language recognition, etc. Action recognition from images is a challenging task as the key information like temporal data, object trajectory, and optical flow are not available in still images. While measuring the size of different regions of the human body i.e., step size, arms span, length of the arm, forearm, and hand, etc., provides valuable clues for identification of the human actions. In this article, a framework for classification of the human actions is presented where humans are detected and localized through faster region-convolutional neural networks followed by morphological image processing techniques. Furthermore, geometric features from human blob are extracted and incorporated into the classification rules for the six human actions i.e., standing, walking, single-hand side wave, single-hand top wave, both hands side wave, and both hands top wave. The performance of the proposed technique has been evaluated using precision, recall, omission error, and commission error. The proposed technique has been comparatively analyzed in terms of overall accuracy with existing approaches showing that it performs well in contrast to its counterparts.}, subject = {Bildanalyse}, language = {en} } @article{SadeghzadehMaddahAhmadietal., author = {Sadeghzadeh, Milad and Maddah, Heydar and Ahmadi, Mohammad Hossein and Khadang, Amirhosein and Ghazvini, Mahyar and Mosavi, Amir Hosein and Nabipour, Narjes}, title = {Prediction of Thermo-Physical Properties of TiO2-Al2O3/Water Nanoparticles by Using Artificial Neural Network}, series = {Nanomaterials}, volume = {2020}, journal = {Nanomaterials}, number = {Volume 10, Issue 4, 697}, publisher = {MDPI}, address = {Basel}, doi = {10.3390/nano10040697}, url = {http://nbn-resolving.de/urn:nbn:de:gbv:wim2-20200421-41308}, abstract = {In this paper, an artificial neural network is implemented for the sake of predicting the thermal conductivity ratio of TiO2-Al2O3/water nanofluid. TiO2-Al2O3/water in the role of an innovative type of nanofluid was synthesized by the sol-gel method. The results indicated that 1.5 vol.\% of nanofluids enhanced the thermal conductivity by up to 25\%. It was shown that the heat transfer coefficient was linearly augmented with increasing nanoparticle concentration, but its variation with temperature was nonlinear. It should be noted that the increase in concentration may cause the particles to agglomerate, and then the thermal conductivity is reduced. The increase in temperature also increases the thermal conductivity, due to an increase in the Brownian motion and collision of particles. In this research, for the sake of predicting the thermal conductivity of TiO2-Al2O3/water nanofluid based on volumetric concentration and temperature functions, an artificial neural network is implemented. In this way, for predicting thermal conductivity, SOM (self-organizing map) and BP-LM (Back Propagation-Levenberq-Marquardt) algorithms were used. Based on the results obtained, these algorithms can be considered as an exceptional tool for predicting thermal conductivity. Additionally, the correlation coefficient values were equal to 0.938 and 0.98 when implementing the SOM and BP-LM algorithms, respectively, which is highly acceptable. View Full-Text}, subject = {W{\"a}rmeleitf{\"a}higkeit}, language = {en} } @article{SaadatfarKhosraviHassannatajJoloudarietal., author = {Saadatfar, Hamid and Khosravi, Samiyeh and Hassannataj Joloudari, Javad and Mosavi, Amir and Shamshirband, Shahaboddin}, title = {A New K-Nearest Neighbors Classifier for Big Data Based on Efficient Data Pruning}, series = {Mathematics}, volume = {2020}, journal = {Mathematics}, number = {volume 8, issue 2, article 286}, publisher = {MDPI}, doi = {10.3390/math8020286}, url = {http://nbn-resolving.de/urn:nbn:de:gbv:wim2-20200225-40996}, pages = {12}, abstract = {The K-nearest neighbors (KNN) machine learning algorithm is a well-known non-parametric classification method. However, like other traditional data mining methods, applying it on big data comes with computational challenges. Indeed, KNN determines the class of a new sample based on the class of its nearest neighbors; however, identifying the neighbors in a large amount of data imposes a large computational cost so that it is no longer applicable by a single computing machine. One of the proposed techniques to make classification methods applicable on large datasets is pruning. LC-KNN is an improved KNN method which first clusters the data into some smaller partitions using the K-means clustering method; and then applies the KNN for each new sample on the partition which its center is the nearest one. However, because the clusters have different shapes and densities, selection of the appropriate cluster is a challenge. In this paper, an approach has been proposed to improve the pruning phase of the LC-KNN method by taking into account these factors. The proposed approach helps to choose a more appropriate cluster of data for looking for the neighbors, thus, increasing the classification accuracy. The performance of the proposed approach is evaluated on different real datasets. The experimental results show the effectiveness of the proposed approach and its higher classification accuracy and lower time cost in comparison to other recent relevant methods.}, subject = {Maschinelles Lernen}, language = {en} } @article{RenZhuangOterkusetal., author = {Ren, Huilong and Zhuang, Xiaoying and Oterkus, Erkan and Zhu, Hehua and Rabczuk, Timon}, title = {Nonlocal strong forms of thin plate, gradient elasticity, magneto-electro-elasticity and phase-field fracture by nonlocal operator method}, series = {Engineering with Computers}, volume = {2021}, journal = {Engineering with Computers}, doi = {10.1007/s00366-021-01502-8}, url = {http://nbn-resolving.de/urn:nbn:de:gbv:wim2-20211207-45388}, pages = {1 -- 22}, abstract = {The derivation of nonlocal strong forms for many physical problems remains cumbersome in traditional methods. In this paper, we apply the variational principle/weighted residual method based on nonlocal operator method for the derivation of nonlocal forms for elasticity, thin plate, gradient elasticity, electro-magneto-elasticity and phase-field fracture method. The nonlocal governing equations are expressed as an integral form on support and dual-support. The first example shows that the nonlocal elasticity has the same form as dual-horizon non-ordinary state-based peridynamics. The derivation is simple and general and it can convert efficiently many local physical models into their corresponding nonlocal forms. In addition, a criterion based on the instability of the nonlocal gradient is proposed for the fracture modelling in linear elasticity. Several numerical examples are presented to validate nonlocal elasticity and the nonlocal thin plate.}, subject = {Bruchmechanik}, language = {en} } @article{RafieeRabczukMilanietal., author = {Rafiee, Roham and Rabczuk, Timon and Milani, Abbas S. and Tserpes, Konstantinos I.}, title = {Advances in Characterization and Modeling of Nanoreinforced Composites}, series = {JOURNAL OF NANOMATERIALS}, journal = {JOURNAL OF NANOMATERIALS}, doi = {10.1155/2016/9481053}, url = {http://nbn-resolving.de/urn:nbn:de:gbv:wim2-20170411-31134}, abstract = {This special issue deals with a range of recently developed characterization and modeling techniques employed to better understand and predict the response of nanoreinforced composites at different scales.}, subject = {Physikalische Eigenschaft}, language = {en} } @article{RabczukGuoZhuangetal., author = {Rabczuk, Timon and Guo, Hongwei and Zhuang, Xiaoying and Chen, Pengwan and Alajlan, Naif}, title = {Stochastic deep collocation method based on neural architecture search and transfer learning for heterogeneous porous media}, series = {Engineering with Computers}, volume = {2022}, journal = {Engineering with Computers}, publisher = {Springer}, address = {London}, doi = {10.1007/s00366-021-01586-2}, url = {http://nbn-resolving.de/urn:nbn:de:gbv:wim2-20220209-45835}, pages = {1 -- 26}, abstract = {We present a stochastic deep collocation method (DCM) based on neural architecture search (NAS) and transfer learning for heterogeneous porous media. We first carry out a sensitivity analysis to determine the key hyper-parameters of the network to reduce the search space and subsequently employ hyper-parameter optimization to finally obtain the parameter values. The presented NAS based DCM also saves the weights and biases of the most favorable architectures, which is then used in the fine-tuning process. We also employ transfer learning techniques to drastically reduce the computational cost. The presented DCM is then applied to the stochastic analysis of heterogeneous porous material. Therefore, a three dimensional stochastic flow model is built providing a benchmark to the simulation of groundwater flow in highly heterogeneous aquifers. The performance of the presented NAS based DCM is verified in different dimensions using the method of manufactured solutions. We show that it significantly outperforms finite difference methods in both accuracy and computational cost.}, subject = {Maschinelles Lernen}, language = {en} } @article{OuaerHosseiniAmaretal., author = {Ouaer, Hocine and Hosseini, Amir Hossein and Amar, Menad Nait and Ben Seghier, Mohamed El Amine and Ghriga, Mohammed Abdelfetah and Nabipour, Narjes and Andersen, P{\aa}l {\O}steb{\o} and Mosavi, Amir and Shamshirband, Shahaboddin}, title = {Rigorous Connectionist Models to Predict Carbon Dioxide Solubility in Various Ionic Liquids}, series = {Applied Sciences}, volume = {2020}, journal = {Applied Sciences}, number = {Volume 10, Issue 1, 304}, publisher = {MDPI}, doi = {https://doi.org/10.3390/app10010304}, url = {http://nbn-resolving.de/urn:nbn:de:gbv:wim2-20200107-40558}, pages = {18}, abstract = {Estimating the solubility of carbon dioxide in ionic liquids, using reliable models, is of paramount importance from both environmental and economic points of view. In this regard, the current research aims at evaluating the performance of two data-driven techniques, namely multilayer perceptron (MLP) and gene expression programming (GEP), for predicting the solubility of carbon dioxide (CO2) in ionic liquids (ILs) as the function of pressure, temperature, and four thermodynamical parameters of the ionic liquid. To develop the above techniques, 744 experimental data points derived from the literature including 13 ILs were used (80\% of the points for training and 20\% for validation). Two backpropagation-based methods, namely Levenberg-Marquardt (LM) and Bayesian Regularization (BR), were applied to optimize the MLP algorithm. Various statistical and graphical assessments were applied to check the credibility of the developed techniques. The results were then compared with those calculated using Peng-Robinson (PR) or Soave-Redlich-Kwong (SRK) equations of state (EoS). The highest coefficient of determination (R2 = 0.9965) and the lowest root mean square error (RMSE = 0.0116) were recorded for the MLP-LMA model on the full dataset (with a negligible difference to the MLP-BR model). The comparison of results from this model with the vastly applied thermodynamic equation of state models revealed slightly better performance, but the EoS approaches also performed well with R2 from 0.984 up to 0.996. Lastly, the newly established correlation based on the GEP model exhibited very satisfactory results with overall values of R2 = 0.9896 and RMSE = 0.0201.}, subject = {Maschinelles Lernen}, language = {en} } @article{NooriMortazaviKeshtkarietal., author = {Noori, Hamidreza and Mortazavi, Bohayra and Keshtkari, Leila and Zhuang, Xiaoying and Rabczuk, Timon}, title = {Nanopore creation in MoS2 and graphene monolayers by nanoparticles impact: a reactive molecular dynamics study}, series = {Applied Physics A}, volume = {2021}, journal = {Applied Physics A}, number = {volume 127, article 541}, publisher = {Springer}, address = {Heidelberg}, doi = {10.1007/s00339-021-04693-5}, url = {http://nbn-resolving.de/urn:nbn:de:gbv:wim2-20210804-44756}, pages = {1 -- 13}, abstract = {In this work, extensive reactive molecular dynamics simulations are conducted to analyze the nanopore creation by nano-particles impact over single-layer molybdenum disulfide (MoS2) with 1T and 2H phases. We also compare the results with graphene monolayer. In our simulations, nanosheets are exposed to a spherical rigid carbon projectile with high initial velocities ranging from 2 to 23 km/s. Results for three different structures are compared to examine the most critical factors in the perforation and resistance force during the impact. To analyze the perforation and impact resistance, kinetic energy and displacement time history of the projectile as well as perforation resistance force of the projectile are investigated. Interestingly, although the elasticity module and tensile strength of the graphene are by almost five times higher than those of MoS2, the results demonstrate that 1T and 2H-MoS2 phases are more resistive to the impact loading and perforation than graphene. For the MoS2nanosheets, we realize that the 2H phase is more resistant to impact loading than the 1T counterpart. Our reactive molecular dynamics results highlight that in addition to the strength and toughness, atomic structure is another crucial factor that can contribute substantially to impact resistance of 2D materials. The obtained results can be useful to guide the experimental setups for the nanopore creation in MoS2or other 2D lattices.}, subject = {Nanomechanik}, language = {en} } @article{NabipourMosaviBaghbanetal., author = {Nabipour, Narjes and Mosavi, Amir and Baghban, Alireza and Shamshirband, Shahaboddin and Felde, Imre}, title = {Extreme Learning Machine-Based Model for Solubility Estimation of Hydrocarbon Gases in Electrolyte Solutions}, series = {Processes}, volume = {2020}, journal = {Processes}, number = {Volume 8, Issue 1, 92}, publisher = {MDPI}, doi = {10.3390/pr8010092}, url = {http://nbn-resolving.de/urn:nbn:de:gbv:wim2-20200113-40624}, pages = {12}, abstract = {Calculating hydrocarbon components solubility of natural gases is known as one of the important issues for operational works in petroleum and chemical engineering. In this work, a novel solubility estimation tool has been proposed for hydrocarbon gases—including methane, ethane, propane, and butane—in aqueous electrolyte solutions based on extreme learning machine (ELM) algorithm. Comparing the ELM outputs with a comprehensive real databank which has 1175 solubility points yielded R-squared values of 0.985 and 0.987 for training and testing phases respectively. Furthermore, the visual comparison of estimated and actual hydrocarbon solubility led to confirm the ability of proposed solubility model. Additionally, sensitivity analysis has been employed on the input variables of model to identify their impacts on hydrocarbon solubility. Such a comprehensive and reliable study can help engineers and scientists to successfully determine the important thermodynamic properties, which are key factors in optimizing and designing different industrial units such as refineries and petrochemical plants.}, subject = {Maschinelles Lernen}, language = {en} }