@article{MTMT:34832941, title = {First-principles calculations of defects and electron-phonon interactions: Seminal contributions of Audrius Alkauskas to the understanding of recombination processes}, url = {https://m2.mtmt.hu/api/publication/34832941}, author = {Zhang, X. and Turiansky, M.E. and Razinkovas, L. and Maciaszek, M. and Broqvist, P. and Yan, Q. and Lyons, J.L. and Dreyer, C.E. and Wickramaratne, D. and Gali, Ádám and Pasquarello, A. and Van de Walle, C.G.}, doi = {10.1063/5.0205525}, journal-iso = {J APPL PHYS}, journal = {JOURNAL OF APPLIED PHYSICS}, volume = {135}, unique-id = {34832941}, issn = {0021-8979}, abstract = {First-principles calculations of defects and electron-phonon interactions play a critical role in the design and optimization of materials for electronic and optoelectronic devices. The late Audrius Alkauskas made seminal contributions to developing rigorous first-principles methodologies for the computation of defects and electron-phonon interactions, especially in the context of understanding the fundamental mechanisms of carrier recombination in semiconductors. Alkauskas was also a pioneer in the field of quantum defects, helping to build a first-principles understanding of the prototype nitrogen-vacancy center in diamond, as well as identifying novel defects. Here, we describe the important contributions made by Alkauskas and his collaborators and outline fruitful research directions that Alkauskas would have been keen to pursue. Audrius Alkauskas’ scientific achievements and insights highlighted in this article will inspire and guide future developments and advances in the field. © 2024 Author(s).}, year = {2024}, eissn = {1089-7550}, orcid-numbers = {Gali, Ádám/0000-0002-3339-5470} } @article{MTMT:34832886, title = {Energy-Dependent, Self-Adaptive Mesh h(p)-Refinement of an Interior-Penalty Scheme for a Discontinuous Galerkin Isogeometric Analysis Spatial Discretization of the Multi-Group Neutron Diffusion Equation with Dual-Weighted Residual Error Measures}, url = {https://m2.mtmt.hu/api/publication/34832886}, author = {Wilson, S.G. and Eaton, M.D. and Kópházi, József}, doi = {10.1080/23324309.2024.2334277}, journal-iso = {J COMPUT THEOR TRANSP}, journal = {JOURNAL OF COMPUTATIONAL AND THEORETICAL TRANSPORT}, unique-id = {34832886}, issn = {2332-4309}, abstract = {Energy-dependent self-adaptive mesh refinement algorithms are developed for a symmetric interior-penalty scheme for a discontinuous Galerkin spatial discretization of the multi-group neutron diffusion equation using NURBS-based isogeometric analysis (IGA). The spatially self-adaptive algorithms employ both mesh (h) and polynomial degree (p) refinement. The discretized system becomes increasingly ill-conditioned for increasingly large penalty parameters; and there is no gain in accuracy for over penalization. Therefore, optimized penalty parameters are rigorously calculated, for general element types, from a coercivity analysis of the bilinear form. Local mesh refinement allows for a better allocation of computational resources; and thus, more accuracy per degree of freedom. Two a posteriori interpolation-based error measures are proposed. The first heuristically minimizes local contributions to the discretization error, which becomes competitive for global quantities of interest (QoIs). However, for localized QoIs, over energy-dependent meshes, certain multi-group components may become under-resolved. The second employs duality arguments to minimize important error contributions, which consistently and reliably reduces the error in the QoI. © 2024 The Author(s). Published with license by Taylor & Francis Group, LLC.}, keywords = {Discontinuous Galerkin; Isogeometric analysis; dual-weighted residual error measures; energy-dependent self-adaptive mesh h(p)-refinement; Multi-group neutron diffusion equation; interior-penalty scheme}, year = {2024}, eissn = {2332-4325} } @article{MTMT:34832872, title = {Automated group constant parameterization for low sample sizes using different Machine learning approaches}, url = {https://m2.mtmt.hu/api/publication/34832872}, author = {Sebestény, Dániel István and Panka, István and Batki, Bálint}, doi = {10.1016/j.anucene.2024.110560}, journal-iso = {ANN NUCL ENERGY}, journal = {ANNALS OF NUCLEAR ENERGY}, volume = {204}, unique-id = {34832872}, issn = {0306-4549}, abstract = {This paper deals with group constant parameterization, a necessary step to utilize the results of assembly-level neutronics calculations at the full-core level. The focus is on low sample size problems when the commonly used linear interpolation approach is inadequate, a typical situation of using Monte Carlo codes for group constant generation. This work presents a newly developed code package for automated group constant parameterization. It implements several machine learning regression models − including a novel polynomial regression algorithm − performs hyperparameter optimization and selects the best model based on a detailed evaluation. The applicability of the new code package is demonstrated in a case study for a VVER-1200 fuel assembly covering both normal operation and transient conditions. In this example, the novel polynomial regression model provides a 73 pcm average error in kinf that leads to reactivity coefficients well within the desired precision. © 2024 The Authors}, keywords = {Regression Analysis; machine learning; sampling; Parameterization; Sample sizes; Machine learning methods; Machine learning methods; Parametrizations; Fuel assembly; Hyper-parameter optimizations; Machine learning approaches; hyperparameter optimization; Group constant parametrization; Vver-1200 fuel assembly; Assembly levels; Group constant; Group constant parametrization; Vve-1200 fuel assembly}, year = {2024}, eissn = {1873-2100} } @article{MTMT:34830134, title = {Periodic Precipitation in a Confined Liquid Layer}, url = {https://m2.mtmt.hu/api/publication/34830134}, author = {Itatani, Masaki and Onishi, Yuhei and Suematsu, Nobuhiko J. and Lagzi, István László}, doi = {10.1021/acs.jpclett.4c00832}, journal-iso = {J PHYS CHEM LETT}, journal = {JOURNAL OF PHYSICAL CHEMISTRY LETTERS}, volume = {15}, unique-id = {34830134}, issn = {1948-7185}, year = {2024}, pages = {4948-4957}, orcid-numbers = {Itatani, Masaki/0000-0003-1025-0452; Suematsu, Nobuhiko J./0000-0001-5860-4147; Lagzi, István László/0000-0002-2303-5965} } @misc{MTMT:34824198, title = {Generalized law of iterated logarithm for the Lorentz gas with infinite horizon}, url = {https://m2.mtmt.hu/api/publication/34824198}, author = {Bálint, Péter and Terhesiu, Dalia}, unique-id = {34824198}, year = {2024} } @article{MTMT:34823661, title = {Terahertz spin-wave excitations in the transverse conical phase of BiFeO3}, url = {https://m2.mtmt.hu/api/publication/34823661}, author = {Tóth, Boglárka and Farkas, D. G. and Amelin, K. and Rõõm, T. and Nagel, U. and Udvardi, L. and Szunyogh, L. and Rózsa, L. and Ito, T. and Bordács, Sándor}, doi = {10.1103/PhysRevB.109.144424}, journal-iso = {PHYS REV B}, journal = {PHYSICAL REVIEW B}, volume = {109}, unique-id = {34823661}, issn = {2469-9950}, year = {2024}, eissn = {2469-9969}, orcid-numbers = {Amelin, K./0000-0003-4106-5006; Szunyogh, L./0000-0001-7430-3627; Rózsa, L./0000-0001-9456-5755; Ito, T./0000-0003-2094-2807; Bordács, Sándor/0000-0003-0420-5997} } @article{MTMT:34818513, title = {Dynamical separation of charge and energy transport in one-dimensional Mott insulators}, url = {https://m2.mtmt.hu/api/publication/34818513}, author = {Møller, Frederik and Nagy, Botond and Kormos, Márton and Takács, Gábor}, doi = {10.1103/PhysRevB.109.L161112}, journal-iso = {PHYS REV B}, journal = {PHYSICAL REVIEW B}, volume = {109}, unique-id = {34818513}, issn = {2469-9950}, abstract = {One-dimensional Mott insulators can be described using the sine-Gordon model, an integrable quantum field theory that provides the low-energy effective description of several one-dimensional gapped condensed matter systems, including recent realizations with trapped ultracold atoms. Employing the theory of generalized hydrodynamics, we demonstrate that this model exhibits separation of the transport of topological charge vs energy. Analysis of the quasiparticle dynamics reveals that the mechanism behind the separation is the reflective scattering between topologically charged kinks/antikinks. The effect of these scattering events is most pronounced at strong coupling and low temperatures, where the distribution of quasiparticles is narrow compared to the reflective scattering amplitude. This effect results in a distinctively shaped “arrowhead” light cone for the topological charge.}, year = {2024}, eissn = {2469-9969}, orcid-numbers = {Møller, Frederik/0000-0002-5095-4393; Takács, Gábor/0000-0002-7075-3580} } @article{MTMT:34817030, title = {Nem akárhonnan érkezett reagálás: A kancellári irányítási modell megbukott}, url = {https://m2.mtmt.hu/api/publication/34817030}, author = {Aszódi, Attila}, journal-iso = {INDEX.HU}, journal = {INDEX.HU}, unique-id = {34817030}, year = {2024}, eissn = {1585-3241} } @misc{MTMT:34816929, title = {Lesz alternatív üzemanyag-szállító az atomerőművek számára a piacon | GENERÁTOR}, url = {https://m2.mtmt.hu/api/publication/34816929}, author = {Somodi-Solymos, Eszter}, unique-id = {34816929}, year = {2024} } @misc{MTMT:34816904, title = {236 ENPOL, Prof. Dr. Aszódi Attila előadása}, url = {https://m2.mtmt.hu/api/publication/34816904}, author = {Aszódi, Attila}, unique-id = {34816904}, year = {2024} }