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27
result(s) for
"Gaussian core model"
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Self-diffusion anomalies of an odd tracer in soft-core media
by
Luigi Muzzeddu, Pietro
,
Metzler, Ralf
,
Kalz, Erik
in
Approximation
,
Dean–Kawasaki equation
,
Density
2025
Odd-diffusive systems, characterised by broken time-reversal and/or parity, have recently been shown to display counterintuitive features such as interaction-enhanced dynamics in the dilute limit. Here we extend the investigation to the high-density limit of an odd tracer embedded in a soft medium described by the Gaussian core model (GCM) using a field-theoretic approach based on the Dean–Kawasaki equation. Our analysis reveals that interactions can enhance the dynamics of an odd tracer even in dense systems. We demonstrate that oddness results in a complete reversal of the well-known self-diffusion ( D s ) anomaly of the GCM. Ordinarily, D s exhibits a non-monotonic trend with increasing density, approaching but remaining below the interaction-free diffusion, D 0 , ( D s < D 0 ) so that D s ↑ D 0 at high densities. In contrast, for an odd tracer, self-diffusion is enhanced ( D s > D 0 ) and the GCM anomaly is inverted, displaying D s ↓ D 0 at high densities. The transition between the standard and reversed GCM anomaly is governed by the tracer’s oddness, with a critical oddness value at which the tracer diffuses as a free particle ( D s ≈ D 0 ) across all densities. We validate our theoretical predictions with Brownian dynamics simulations, finding strong agreement between the them.
Journal Article
Pole Analysis of the Inter-Replica Correlation Function in a Two-Replica System as a Binary Mixture: Mean Overlap in the Cluster Glass Phase
2024
To investigate the cluster glass phase of ultrasoft particles, we examine an annealed two-replica system endowed with an attractive inter-replica field similar to that of a binary symmetric electrolyte. Leveraging this analogy, we conduct pole analysis on the total correlation functions in the two-replica system where the inter-replica field will eventually be switched off. By synthesizing discussions grounded in the pole analysis with a hierarchical view of the free-energy landscape, we derive an analytical form of the mean overlap between two replicas within the mean field approximation of the Gaussian core model. This formula elucidates novel numerical findings observed in the cluster glass phase.
Journal Article
A J-function for Inhomogeneous Spatio-temporal Point Processes
by
CRONIE, O.
,
VAN LIESHOUT, M. N. M.
in
(reduced Palm measure) generating functional
,
Correlation
,
Estimators
2015
We propose a new summary statistic for inhomogeneous intensity-reweighted moment stationarity spatio-temporal point processes. The statistic is defined in terms of the n-point correlation functions of the point process, and it generalizes the J-function when stationarity is assumed. We show that our statistic can be represented in terms of the generating functional and that it is related to the spatio-temporal K-function. We further discuss its explicit form under some specific model assumptions and derive ratio-unbiased estimators. We finally illustrate the use of our statistic in practice.
Journal Article
The global geomagnetic field over the historical era: what can we learn from ship-log declinations?
by
Schanner, Maximilian
,
Bohsung, Lukas
,
Holschneider, Matthias
in
Datasets
,
Declination
,
Dipole moments
2023
Modern geomagnetic field models are constructed from satellite and observatory data, while models on the millennial timescale are constructed from indirect records of thermoremanent and sedimentary origin. An intermediate period, spanning the last four centuries, is covered by historical survey data and ship-logs, which is strongly dominated by geomagnetic declination information. We apply a sequentialized, Gaussian process-based modeling technique to this dataset and propose a new field model for this era. In order to investigate the information gained from declination records from ship-logs, we separate the dataset and construct a second model, where unpaired declination records (i.e., measurements where only declinations are reported and the rest of the field vector is missing) are removed. The availability of more records helps notably to constrain global field properties like the dipole moment. It also allows to resolve some detailed field structures more accurately. Based on the model constructed from the full dataset, we perform an analysis of the South Atlantic Anomaly and regions of low field intensity in general. We extend a recent analysis of center of mass movement and area evolution of the South Atlantic Anomaly further back in time and confirm the findings of its non-monotonous growth.
Journal Article
Bayesian age models and stacks: combining age inferences from radiocarbon and benthic δ18O stratigraphic alignment
by
Lawrence, Charles
,
Lisiecki, Lorraine E
,
Gebbie, Geoffrey
in
Alignment
,
Bayesian analysis
,
Bayesian theory
2023
Previously developed software packages that generate probabilistic age models for ocean sediment cores are designed to either interpolate between different age proxies at discrete depths (e.g., radiocarbon, tephra layers, or tie points) or perform a probabilistic stratigraphic alignment to a dated target (e.g., of benthic δ18O) and cannot combine age inferences from both techniques. Furthermore, many radiocarbon dating packages are not specifically designed for marine sediment cores, and the default settings may not accurately reflect the probability of sedimentation rate variability in the deep ocean, thus requiring subjective tuning of the parameter settings. Here we present a new technique for generating Bayesian age models and stacks using ocean sediment core radiocarbon and probabilistic alignment of benthic δ18O data, implemented in a software package named BIGMACS (Bayesian Inference Gaussian Process regression and Multiproxy Alignment of Continuous Signals). BIGMACS constructs multiproxy age models by combining age inferences from both radiocarbon ages and probabilistic benthic δ18O stratigraphic alignment and constrains sedimentation rates using an empirically derived prior model based on 37 14C-dated ocean sediment cores (Lin et al., 2014). BIGMACS also constructs continuous benthic δ18O stacks via a Gaussian process regression, which requires a smaller number of cores than previous stacking methods. This feature allows users to construct stacks for a region that shares a homogeneous deep-water δ18O signal, while leveraging radiocarbon dates across multiple cores. Thus, BIGMACS efficiently generates local or regional stacks with smaller uncertainties in both age and δ18O than previously available techniques. We present two example regional benthic δ18O stacks and demonstrate that the multiproxy age models produced by BIGMACS are more precise than their single-proxy counterparts.
Journal Article
Applying Gaussian Process Regression for Machine Learning-Assisted Reactor Simulations
This study explores the integration of machine learning, specifically Gaussian Process Regression (GPR), into traditional reactor core simulations. Building upon previous work on Boiling Water Reactors (BWR), GPR is implemented to predict and correct errors in lower-fidelity simulation outcomes. The findings demonstrate significant improvements in prediction accuracy when GPR is coupled with the diffusion-based core simulator, exhibiting remarkable reductions in both k eff and nodal power errors. The comparison reveals that the GPR-enhanced core simulation model significantly outperforms both the standalone simulation and a combination of simulation with Multivariate Linear Regression. It also competes effectively with the performance of a Deep Neural Network-enhanced model. Importantly, this methodology enhances simulation accuracy while maintaining low computational costs. The research emphasizes the vast potential of machine learning, particularly GPR, in progressing nuclear reactor simulations, highlighting the immense value of combining traditional simulation methods with advanced statistical learning techniques.
Journal Article
Combined use of plasma p‐tau217, NfL, and GFAP predicts domain‐specific cognitive decline in cognitively unimpaired and MCI individuals
by
Fatima, Hadia
,
Gatchel, Jennifer
,
Kivisäkk, Pia
in
Aged
,
Aged, 80 and over
,
Alzheimer's disease
2025
INTRODUCTION Accurate identification of individuals at risk for cognitive decline is critical for treatment planning and trial enrichment strategies. We evaluated the combined utility of plasma phosphorylated tau at threonine 217 (p‐tau217), neurofilament light chain (NfL), and glial fibrillary acidic protein (GFAP) in predicting domain‐specific cognitive decline. METHODS Participants (n = 523; 40.9% cognitively unimpaired [CU]; 59.1% mild cognitive impairment [MCI]) were from the Massachusetts Alzheimer's Disease Research Center. Cognition was assessed using the National Alzheimer's Coordinating Center Uniform Data Set. Participants were classified as high(+)/low(−) for each biomarker using Gaussian mixture models. RESULTS Among all participants, high p‐tau217 alone [p‐tau217(+)NfL(–)GFAP(–)] was associated with a steeper decline in episodic/semantic memory and processing speed compared to the all‐low group (p ≤ 0.02). With the addition of high GFAP [p‐tau217(+)NfL(–)GFAP(+)], steeper decline extended to most cognitive domains, including global cognition and executive function, compared to the all‐low group. In CU, faster decline in global cognition and executive function was seen when all biomarkers were elevated ([p‐tau217(+)NfL(+)GFAP(+)]; p ≤ 0.04). DISCUSSION Combined plasma biomarkers predict decline in cognitive domains vulnerable to early disease. Highlights High phosphorylated tau at threonine 217 (p‐tau217) alone was associated with declines in semantic/episodic memory, whereas its combination with elevated glial fibrillary acidic protein (GFAP) predicted declines in a wider range of cognitive domains. Elevated neurofilament light chain (NfL) amplifies the cognitive decline already driven by p‐tau217 and GFAP. In cognitively unimpaired individuals, subtle domain‐specific cognitive declines can be detected when both core and non‐core Alzheimer's disease biomarkers are used. Our finding highlights the importance of focusing on vulnerable cognitive domains during early disease where global cognition may appear stable but specific impairments can be masked within composite scores.
Journal Article
Evaluation of Reservoir Porosity and Permeability from Well Log Data Based on an Ensemble Approach: A Comprehensive Study Incorporating Experimental, Simulation, and Fieldwork Data
by
Abdulmalik, Alaa
,
Guanhua, Sun
,
Naqibulla, Safi
in
Artificial neural networks
,
Back propagation networks
,
Core analysis
2025
Permeability and porosity are key parameters in reservoir characterization for understanding hydrocarbon flow behavior. While traditional laboratory core analysis is time-consuming, machine learning has emerged as a valuable tool for more efficient and accurate estimation. This paper proposes an ensemble technique called adaptive boosting (AdaBoost) for porosity and permeability estimation, utilizing methods such as support vector machine (SVM), Gaussian process regression (GPR), multivariate analysis, and backpropagation neural network (BPNN) for prediction based on well logs. Performance evaluation metrics including root mean square error, mean square error, and coefficient of determination (R2) were used to compare the models. The results demonstrate that AdaBoost outperformed GPR, SVM, and BPNN models in terms of processing time and accuracy, achieving R2 values of 0.980 and 0.962 for permeability and porosity during training, respectively, and 0.960 and 0.951 during testing, respectively. This study highlights AdaBoost as a robust and accurate technique that can enhance reservoir characterization.
Journal Article
Data-Driven Predictive Modeling of Lithofacies and Fe In-Situ Grade in the Assen Fe Ore Deposit of the Transvaal Supergroup (South Africa) and Implications on the Genesis of Banded Iron Formations
by
Burnett, Mark
,
Bourdeau, Julie E.
,
Nwaila, Glen T.
in
Algorithms
,
Artificial neural networks
,
Assen Fe ore deposit
2022
The Assen Fe ore deposit is a banded iron formation (BIF)-hosted orebody, occurring in the Penge Formation of the Transvaal Supergroup, located 50 km northwest of Pretoria in South Africa. Most BIF-hosted Fe ore deposits have experienced post-depositional alteration including supergene enrichment of Fe and low-grade regional metamorphism. Unlike most of the known BIF-hosted Fe ore deposits, high-grade hematite (> 60% Fe) in the Assen Fe ore deposit is located along the lithological contacts with dolerite intrusions. Due to the variability in alteration levels, identifying the lithologies present within the various parts of the Assen Fe ore deposit, specifically within the weathering zone, is often challenging. To address this challenge, machine learning was applied to enable the automatic classification of rock types identified within the Assen Fe ore mine and to predict the in-situ Fe grade. This classification is based on geochemical analyses, as well as petrography and geological mapping. A total of 21 diamond core drill cores were sampled at 1 m intervals, covering all the lithofacies present at Assen mine. These were analyzed for major elements and oxides by means of X-ray fluorescence spectrometry. Numerous machine learning algorithms were trained, tested and cross-validated for automated lithofacies classification and prediction of in-situ Fe grade, namely (a) k-nearest neighbors, (b) elastic-net, (c) support vector machines (SVMs), (d) adaptive boosting, (e) random forest, (f) logistic regression, (g) Naïve Bayes, (h) artificial neural network (ANN) and (i) Gaussian process algorithms. Random forest, SVM and ANN classifiers yield high classification accuracy scores during model training, testing and cross-validation. For in-situ Fe grade prediction, the same algorithms also consistently yielded the best results. The predictability of in-situ Fe grade on a per-lithology basis, combined with the fact that CaO and SiO
2
were the strongest predictors of Fe concentration, support the hypothesis that the process that led to Fe enrichment in the Assen Fe ore deposit is dominated by supergene processes. Moreover, we show that predictive modeling can be used to demonstrate that in this case, the main differentiator between the predictability of Fe concentration between different lithofacies lies in the strength of multivariate elemental associations between Fe and other oxides. Localized high-grade Fe ore along with lithological contacts with dolerite intrusion is indicative of intra-basinal fluid circulation from an already Fe-enriched hematite. These findings have a wider implication on lithofacies classification in weathered rocks and mobility of economic valuable elements such as Fe.
Journal Article