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Density Functional Resonance Theory (DFRT) is a complex-scaled version of ground-state Density Functional Theory (DFT) that allows one to calculate the resonance energies and lifetimes of metastable anions. In this formalism, the exact…

Quantum Physics · Physics 2011-11-09 Daniel L. Whitenack , Adam Wasserman

Aspects of Density Functional Resonance Theory (DFRT) [Phys. Rev. Lett. \textbf{107}, 163002 (2011)], a recently developed complex-scaled version of ground-state Density Functional Theory (DFT), are studied in detail. The asymptotic…

Quantum Physics · Physics 2015-06-04 Daniel L. Whitenack , Adam Wasserman

Discrete trigonometric transformations, such as the discrete Fourier and cosine/sine transforms, are important in a variety of applications due to their useful properties. For example, one well-known property is the convolution theorem for…

Information Theory · Computer Science 2015-10-05 Xing Ouyang , Cleitus Antony , Fatima Gunning , Hongyu Zhang , Yong Liang Guan

The purpose of this work is to describe in detail the development of the Spectral Difference Raviart-Thomas (SDRT) formulation for two and three-dimensional tensor-product elements and simplexes. Through the process, the authors establish…

Numerical Analysis · Mathematics 2021-05-19 Gonzalo Sáez-Mischlich , Javier Sierra-Ausín , Jérémie Gressier

Graph spectral representations are fundamental in graph signal processing, offering a rigorous framework for analyzing and processing graph-structured data. The graph fractional Fourier transform (GFRFT) extends the classical graph Fourier…

Machine Learning · Statistics 2025-11-21 Feiyue Zhao , Yangfan He , Zhichao Zhang

We unify the discrete Fourier transform (DFT), discrete cosine transform (DCT), Walsh-Hadamard, Haar wavelet, Karhunen-Lo\`eve transform, and several others along with their continuous counterparts (Fourier transform, Fourier series,…

Signal Processing · Electrical Eng. & Systems 2026-05-19 Mitchell A. Thornton

Accurately reconstructing continuous flow fields from sparse or indirect measurements remains an open challenge, as existing techniques often suffer from oversmoothing artifacts, reliance on heterogeneous architectures, and the…

Graphics · Computer Science 2025-04-03 Xingyu Ni , Jingrui Xing , Xingqiao Li , Bin Wang , Baoquan Chen

This paper develops a constructive numerical scheme for Fourier-Bessel approximations on disks compatible with convolutions supported on disks. We address accurate finite Fourier-Bessel transforms (FFBT) and inverse finite Fourier-Bessel…

Numerical Analysis · Mathematics 2023-11-08 Arash Ghaani Farashahi , Gregory S. Chirikjian

The Fractional Fourier Transform (FRT) corresponds to an arbitrary-angle rotation in the phase space, e.g. the time-frequency (TF) space, and generalizes the fundamentally important Fourier Transform. FRT applications range from classical…

Optics · Physics 2024-03-06 Michał Lipka , Michał Parniak

The one-dimensional (1D) fractional Fourier transform (FRFT) generalizes the Fourier transform, offering significant advantages in the time-frequency analysis of non-stationary signals. While various 2D extensions exist, such as the 2D…

Signal Processing · Electrical Eng. & Systems 2026-03-03 Daxiang Li , Zhichao Zhang , Wei Yao

The significance of the broken ray transform (BRT) is due to its occurrence in a number of modalities spanning optical, x-ray, and nuclear imaging. When data are indexed by the scatter location, the BRT is both linear and shift invariant.…

Signal Processing · Electrical Eng. & Systems 2019-08-07 Michael R. Walker , Joseph A. O'Sullivan

This summary of the doctoral thesis provides a comprehensive formulation of the Extended Discrete Fourier Transform (EDFT), derived directly from the Fourier integral and its orthogonality properties. The method is obtained by solving…

Data Structures and Algorithms · Computer Science 2026-01-21 Vilnis Liepins

Learning-based models for fluid dynamics often operate in unconstrained function spaces, leading to physically inadmissible, unstable simulations. While penalty-based methods offer soft regularization, they provide no structural guarantees,…

Machine Learning · Computer Science 2026-03-26 Xigui Li , Hongwei Zhang , Ruoxi Jiang , Deshu Chen , Chensen Lin , Limei Han , Yuan Qi , Xin Guo , Yuan Cheng

In this paper, we have studied continuous fractional wavelet transform (CFrWT) in $n$-dimensional Euclidean space $\mathbb{R}^n$ with dilation parameter $\boldsymbol a=(a_{1},a_{2},\ldots,a_{n}),$ such that none of $a_{i}'s$ are zero.…

Functional Analysis · Mathematics 2019-12-20 Amit K. Verma , Bivek Gupta

We showcase the advantages of orbital-free density-potential functional theory (DPFT), a more flexible variant of Hohenberg-Kohn density functional theory. DPFT resolves the usual trouble with the gradient-expanded kinetic energy functional…

Quantum Gases · Physics 2021-06-16 Martin-Isbjörn Trappe , Jun Hao Hue , Berthold-Georg Englert

Nonuniform Fourier data are routinely collected in applications such as magnetic resonance imaging, synthetic aperture radar, and synthetic imaging in radio astronomy. To acquire a fast reconstruction that does not require an online inverse…

Numerical Analysis · Mathematics 2016-10-05 Anne Gelb , Guohui Song

An integrated photonic circuit architecture to perform a modified-convolution operation based on the Discrete Fractional Fourier Transform (DFrFT) is introduced. This is accomplished by utilizing two nonuniformly-coupled waveguide lattices…

Optics · Physics 2025-02-25 Kevin Zelaya , Mohammad-Ali Miri

Progress towards the energy breakthroughs needed to combat climate change can be significantly accelerated through the efficient simulation of atomic systems. Simulation techniques based on first principles, such as Density Functional…

Machine Learning · Computer Science 2021-06-18 Muhammed Shuaibi , Adeesh Kolluru , Abhishek Das , Aditya Grover , Anuroop Sriram , Zachary Ulissi , C. Lawrence Zitnick

We present a differentiation framework for plane-wave density-functional theory (DFT) that combines the strengths of forward-mode algorithmic differentiation (AD) and density-functional perturbation theory (DFPT). In the resulting AD-DFPT…

Materials Science · Physics 2025-12-23 Niklas Frederik Schmitz , Bruno Ploumhans , Michael F. Herbst

We extend Fourier analysis to curved spaces by defining a Generalized Fourier Transform (GFT) on any Riemannian manifold $\Sigma$ via spectral decomposition. Under minimal requirements that the transform is an isometric isomorphism and has…

Mathematical Physics · Physics 2026-05-12 Seramika Ariwahjoedi , Muhammad Farchani Rosyid , Andika Kusuma Wijaya
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