UKRmol+: A suite for modelling electronic processes in molecules interacting with electrons, positrons and photons using the R-matrix method

Z Mašín, J Benda, JD Gorfinkiel, AG Harvey… - Computer Physics …, 2020 - Elsevier
UKRmol+ is a new implementation of the time-independent UK R-matrix electron–molecule
scattering code. Key features of the implementation are the use of quantum chemistry codes …

Localized spectral analysis on the sphere

MA Wieczorek, FJ Simons - Geophysical Journal International, 2005 - academic.oup.com
It is often advantageous to investigate the relationship between two geophysical data sets in
the spectral domain by calculating admittance and coherence functions. While there exist …

Evaluation of the rotation matrices in the basis of real spherical harmonics

MA Blanco, M Flórez, M Bermejo - Journal of Molecular structure …, 1997 - Elsevier
Rotation matrices (or Wigner D functions) are the matrix representations of the rotation
operators in the basis of spherical harmonics. They are the key entities in the generation of …

General multivariate linear modeling of surface shapes using SurfStat

MK Chung, KJ Worsley, BM Nacewicz, KM Dalton… - Neuroimage, 2010 - Elsevier
Although there are many imaging studies on traditional ROI-based amygdala volumetry,
there are very few studies on modeling amygdala shape variations. This paper presents a …

[图书][B] Handbook of neuroimaging data analysis

H Ombao, M Lindquist, W Thompson, J Aston - 2016 - taylorfrancis.com
This book explores various state-of-the-art aspects behind the statistical analysis of
neuroimaging data. It examines the development of novel statistical approaches to model …

RMT: R-matrix with time-dependence. Solving the semi-relativistic, time-dependent Schrödinger equation for general, multielectron atoms and molecules in intense …

AC Brown, GSJ Armstrong, J Benda… - Computer Physics …, 2020 - Elsevier
RMT is a programme which solves the time-dependent Schrödinger equation for general,
multielectron atoms, ions and molecules interacting with laser light. As such it can be used to …

[PDF][PDF] Development of a relativistic full-potential first-principles multiple scattering Green function method applied to complex magnetic textures ofnano structures at …

DSG Bauer - 2014 - core.ac.uk
This thesis is concerned with the quantum mechanical investigation of a novel class of
magnetic phenomena in atomic-and nanoscale-sized systems deposited on surfaces or …

Directional feedback delay network

B Alary, A Politis, SJ Schlecht… - AES: Journal of the Audio …, 2019 - research.aalto.fi
Artificial reverberation algorithms are used to enhance dry audio signals. Delay-based
reverberators can produce a realistic effect at a reasonable computational cost. While the …

Extensions of the time-dependent density functional based tight-binding approach

A Domínguez, B Aradi, T Frauenheim… - Journal of Chemical …, 2013 - ACS Publications
The time-dependent density functional based tight-binding (TD-DFTB) approach is
generalized to account for fractional occupations. In addition, an on-site correction leads to …

A spherical convolutional neural network for white matter structure imaging via dMRI

S Sedlar, A Alimi, T Papadopoulo, R Deriche… - … Image Computing and …, 2021 - Springer
Abstract Diffusion Magnetic Resonance Imaging (dMRI) is a powerful non-invasive and in-
vivo imaging modality for probing brain white matter structure. Convolutional neural …