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The quasi-steady state approximation and time-scale separation are commonly applied methods to simplify models of biochemical reaction networks based on ordinary differential equations (ODEs). The concentrations of the "fast" species are…

动力系统 · 数学 2016-05-10 Meritxell Sáez , Carsten Wiuf , Elisenda Feliu

We consider inference for the reaction rates in discretely observed networks such as those found in models for systems biology, population ecology and epidemics. Most such networks are neither slow enough nor small enough for inference via…

统计方法学 · 统计学 2014-02-05 Paul Fearnhead , Vasileios Giagos , Chris Sherlock

This letter explains a new, highly sensitive method for the detection of neutrons, which uses the T$_{1/2}=845$ ns delay in the decay of $^{128}$I at the 137.8 keV energy level, resulting from the capture of thermal neutrons by iodine…

仪器与探测器 · 物理学 2017-03-08 E. Yakushev , S. Rozov , A. Drokhlyansky , D. Filosofov , Z. Kalaninova , V. Timkin , D. Ponomarev

An improved version of a recently developed stochastic cluster dynamics (SCD) method {[}Marian, J. and Bulatov, V. V., {\it J. Nucl. Mater.} \textbf{415} (2014) 84-95{]} is introduced as an alternative to rate theory (RT) methods for…

数据结构与算法 · 计算机科学 2016-05-04 Tuan L. Hoang , Jaime Marian , Vasily V. Bulatov , Peter Hosemann

Direct reaction techniques are powerful tools to study the single-particle nature of nuclei. Performing direct reactions on short-lived nuclei requires radioactive ion beams produced either via fragmentation or the Isotope Separation OnLine…

A novel compute intensification methodology to the construction of low-dimensional, high-fidelity "compact" kinetic models for NOX formation is designed and demonstrated. The method adapts the data intensive Machine Learned Optimization of…

化学物理 · 物理学 2023-06-21 Mark Kelly , Harry Dunne , Gilles Bourque , Stephen Dooley

Skeleton-based action recognition has attracted considerable attention due to its compact representation of the human body's skeletal sructure. Many recent methods have achieved remarkable performance using graph convolutional networks…

计算机视觉与模式识别 · 计算机科学 2023-07-20 Jungho Lee , Minhyeok Lee , Suhwan Cho , Sungmin Woo , Sungjun Jang , Sangyoun Lee

A basic prediction of the statistical model of compound nucleus reactions is that the partial widths for decay into any open channel channel fluctuate according to the Porter-Thomas distribution (PTD). A recent experiment on $s$- and…

核理论 · 物理学 2018-11-06 P. Fanto , G. F. Bertsch , Y. Alhassid

Forward uncertainty quantification in dynamical systems is challenging due to non-smooth or locally oscillating nonlinear behaviors. Spline dimensional decomposition (SDD) addresses such nonlinearity by partitioning input coordinates via…

机器学习 · 统计学 2025-06-18 Yeonsu Kim , Junhan Lee , Bingran Wang , John T. Hwang , Dongjin Lee

The extension of the highly-optimized local natural orbital (LNO) CCSD(T) method is presented for high-spin open-shell molecules. The techniques enabling the outstanding efficiency of the closed-shell LNO-CCSD(T) variant are adopted,…

化学物理 · 物理学 2023-11-17 P. Bernát Szabó , József Csóka , Mihály Kállay , Péter R. Nagy

A key ingredient in any numerical study of supernova explosions is the nuclear network routine that is coupled with the hydrodynamic simulation code. When these studies are performed in more than one dimension, the size of the network is…

太阳与恒星天体物理 · 物理学 2022-03-14 Axel Sanz , Rubén Cabezón , Domingo García-Senz

Estimating rate coefficients from complex chemical reactions is essential for advancing detailed chemistry. However, the stiffness inherent in real-world atmospheric chemistry systems poses severe challenges, leading to training instability…

机器学习 · 计算机科学 2025-09-01 Wenqing Peng , Zhi-Song Liu , Michael Boy

Understanding and prediction of the chemical reactions are fundamental demanding in the study of many complex chemical systems. Reactive molecular dynamics (MD) simulation has been widely used for this purpose as it can offer atomic details…

化学物理 · 物理学 2020-11-12 Jinzhe Zeng , Liqun Cao , Mingyuan Xu , Tong Zhu , John ZH Zhang

Understanding the training dynamics of deep neural networks remains a major open problem, with physics-inspired approaches offering promising insights. Building on this perspective, we develop a thermodynamic framework to describe the…

New multipurpose skeletal and reduced chemical-kinetic mechanisms for ethanol combustion are developed, along the same philosophical lines followed in our previous work on methanol. The resulting skeletal mechanism contains 66 reactions,…

We present results for a suite of fourteen three-dimensional, high resolution hydrodynamical simulations of delayed-detonation modelsof Type Ia supernova (SN Ia) explosions. This model suite comprises the first set of three-dimensional SN…

We consider the important problem of estimating parameter sensitivities for stochastic models of reaction networks that describe the dynamics as a continuous-time Markov process over a discrete lattice. These sensitivity values are useful…

概率论 · 数学 2018-01-12 Ankit Gupta , Muruhan Rathinam , Mustafa Khammash

Inferring future activity information based on observed activity data is a crucial step to improve the accuracy of early activity prediction. Traditional methods based on generative adversarial networks(GAN) or joint learning frameworks can…

计算机视觉与模式识别 · 计算机科学 2024-07-09 Tingyu Liu , Jun Huang , Chenyi Weng

Accurate dynamic models are crucial for many robotic applications. Traditional approaches to deriving these models are based on the application of Lagrangian or Newtonian mechanics. Although these methods provide a good insight into the…

机器人学 · 计算机科学 2024-11-08 Giulia d'Addato , Ruggero Carli , Eurico Pedrosa , Artur Pereira , Luigi Palopoli , Daniele Fontanelli

Isotope thermometry, widely used to measure the temperature of a hot nuclear system formed in energetic nuclear collisions, is examined in the light of S-matrix approach to the nuclear equation of state of disassembled nuclear matter.…

核理论 · 物理学 2010-04-14 S. K. Samaddar , J. N. De