13 citations · 13 across the 2 of their papers we have counts for
5 papers
mudirac: a Dirac equation solver for elemental analysis with muonic X-rays
Simone Sturniolo
We present a new open source software for the integration of the radial Dirac equation developed specifically with muonic atoms in mind. The software, called mudirac, is written in…
Computational Prediction of Muon Stopping Sites: a Novel Take on the Unperturbed Electrostatic Potential Method
Simone Sturniolo, Leandro Liborio
Finding the stopping site of the muon in a muon-spin relaxation experiment is one of the main problems of muon spectroscopy, and computational techniques that make use of quantum c…
Comparison between Density Functional Theory and Density Functional Tight Binding approaches for finding the muon stopping site in organic molecular crystals
Simone Sturniolo, Leandro Liborio, Samuel Jackson
Finding the possible stopping sites for muons inside a crystalline sample is a key problem of muon spectroscopy. In a previous work, we suggested a computational approach to this p…
The Lorentz sphere visualized
Simone Sturniolo, Jonathan Yates
From the inception of Nuclear Magnetic Resonance as a spectroscopic technique, the local origin of chemical shifts has been a topic of discussion. A useful concept employed to desc…
Quantum operators for the computation of exponential weighted integrals of expectation values
Simone Sturniolo
An analytically derived 'integral operator' approach is introduced to estimate the expectation value of a quantum operator for an evolving state weighted with an exponential functi…