Related papers: Characterizing digital microstructures by the Mink…
We present a high-accuracy procedure for electronic structure calculations of strongly correlated materials. To address limitations in current electronic structure methods, we employ density functional theory in combination with the…
To efficiently express tensor data using the Tucker format, a critical task is to minimize the multilinear rank such that the model would not be over-flexible and lead to overfitting. Due to the lack of rank minimization tools in tensor,…
The microstructure critically governs the properties of materials used in energy and chemical engineering technologies, from catalysts and filters to thermal insulators and sensors. Therefore, accurate design is based on quantitative…
Additive manufacturing methods together with topology optimization have enabled the creation of multiscale structures with controlled spatially-varying material microstructure. However, topology optimization or inverse design of such…
Tensor decompositions have become essential tools for feature extraction and compression of multiway data. Recent advances in tensor operators have enabled desirable properties of standard matrix algebra to be retained for multilinear…
Using concepts from integral geometry, we propose a definition for a local coarse-grained curvature tensor that is well-defined on polygonal surfaces. This coarse-grained curvature tensor shows fast convergence to the curvature tensor of…
Quadratic Poisson tensors of the Dufour-Haraki classification read as a sum of an $r$-matrix induced structure twisted by a (small) compatible exact quadratic tensor. An appropriate bigrading of the space of formal Poisson cochains then…
We present tensor networks for feature extraction and refinement of classifier performance. These networks can be initialised deterministically and have the potential for implementation on near-term intermediate-scale quantum (NISQ)…
We apply recent advances in machine learning and computer vision to a central problem in materials informatics: The statistical representation of microstructural images. We use activations in a pre-trained convolutional neural network to…
Pixel- and voxel-based representations of microstructures obtained from tomographic imaging methods is an established standard in computational materials science. The corresponding highly resolved, uniform discretitization in numerical…
Real-world physical systems, like composite materials and porous media, exhibit complex heterogeneities and multiscale nature, posing significant computational challenges. Computational homogenization is useful for predicting macroscopic…
The local Minkowski tensors are valuations on the space of convex bodies in Euclidean space with values in a space of tensor measures. They generalize at the same time the intrinsic volumes, the curvature measures and the isometry covariant…
Dynamic multilayer networks are frequently used to describe the structure and temporal evolution of multiple relationships among common entities, with applications in fields such as sociology, economics, and neuroscience. However,…
We apply the Minkowski Tensor statistics to two dimensional slices of the three dimensional density field. The Minkowski Tensors are a set of functions that are sensitive to directionally dependent signals in the data, and furthermore can…
Compressed sensing extends from the recovery of sparse vectors from undersampled measurements via efficient algorithms to the recovery of matrices of low rank from incomplete information. Here we consider a further extension to the…
Tensor structured Markov chains are part of stochastic models of many practical applications, e.g., in the description of complex production or telephone networks. The most interesting question in Markov chain models is the determination of…
Progress in functional materials discovery has been accelerated by advances in high throughput materials synthesis and by the development of high-throughput computation. However, a complementary robust and high throughput structural…
Properties of crystalline materials are closely linked to microstructure arising from the spatial arrangement, orientation, and phase of nanocrystals. Rapid characterization of crystalline microstructure can accelerate the identification of…
The characterisation of small low conducting inclusions in an otherwise uniform background from low-frequency electrical field measurements has important applications in medical imaging using electrical impedance tomography as well as in…
The proposed article aims at offering a comprehensive tutorial for the computational aspects of structured matrix and tensor factorization. Unlike existing tutorials that mainly focus on {\it algorithmic procedures} for a small set of…