Thermal neutron cross sections of aluminum and magnesium fluorides and quantum kinetic energy of fluorine

M Margherita Simoni (Physics Department, Università degli Studi di Roma Tor Vergata 1 , via della Ricerca Scientifica 1, 00133 Roma,) S Setareh Fatemi (National Institute of Nuclear Physics (INFN), Unit of Pavia 2 , via A. Bassi 6, Pavia 27100,) L Lorenzo Airoldi (Department of Chemistry, University of Pavia 3 , V.le Taramelli 12, Pavia I27100,) S Silva Bortolussi (National Institute of Nuclear Physics (INFN), Unit of Pavia 2 , via A. Bassi 6, Pavia 27100,) M Mattia Gaboardi (Physics Department and NAST Centre, Università degli Studi di Roma Tor Vergata 1 , via della Ricerca Scientifica 1, 00133 Roma,) M Matthew Krzystyniak A Anna Marsicano (ISIS Neutron and Muon Source, Rutherford Appleton Laboratory 5 , Chilton OX11 0QX,) T Triestino Minniti (Physics Department, Università degli Studi di Roma Tor Vergata 1 , via della Ricerca Scientifica 1, 00133 Roma,) I Ignacio Porras (Department of Atomic, Molecular and Nuclear Physics, University of Granada 6 , Avenida de Fuentenueva S/N, CP:18071 Granada,) I Ian Postuma (National Institute of Nuclear Physics (INFN), Unit of Pavia 2 , via A. Bassi 6, Pavia 27100,) R Ricardo Ramos (National Institute of Nuclear Physics (INFN), Unit of Pavia 2 , via A. Bassi 6, Pavia 27100,) R Roberto Senesi (Physics Department, Università degli Studi di Roma Tor Vergata 1 , via della Ricerca Scientifica 1, 00133 Roma,) U Umberto Anselmi Tamburini (National Institute of Nuclear Physics (INFN), Unit of Pavia 2 , via A. Bassi 6, Pavia 27100,) V Valerio Vercesi (National Institute of Nuclear Physics (INFN), Unit of Pavia 2 , via A. Bassi 6, Pavia 27100,) G Giovanni Romanelli (Physics Department, Università degli Studi di Roma Tor Vergata 1 , via della Ricerca Scientifica 1, 00133 Roma,)

Abstract

We provide the modeling and experimental validation of thermal neutron cross sections, including scattering and absorption contributions, of aluminum fluoride and magnesium fluoride, as well as MgF2–AlF3 and AlF3–LiF mixtures, in the neutron energy range between 0.6 meV and 1 keV. The neutron scattering properties have been investigated as a function of temperature, between 10 and 370 K, and sample microscopic structure, focusing in particular on differences between powder and sintered samples. Concurrent measurements of neutron transmission, neutron diffraction, neutron resonance capture analysis, and neutron Compton scattering provide a comprehensive picture of scattering and transport properties of these materials. We provide crystallographic information at the atomic scale, the effect of sintering on the grain size at the nanometer scale, the related occurrence of small angle scattering, and the impact of fluorine zero-point nuclear energy at different temperatures, requiring the use of an effective temperature to model its scattering within the impulse approximation. Finally, combining this self-consistent experimental information, we discuss the application of the uncertainty principle to the fluorine single-particle potential.

Article Details

Volume / Issue Vol. 163, Issue 16
Published October 28, 2025
ISSN 0021-9606
Publisher American Institute of Physics

Journal Info

The Journal of Chemical Physics

American Institute of Physics

ISSN: 0021-9606 Physical Sciences

Authors (15)

M

Margherita Simoni

Physics Department, Università degli Studi di Roma Tor Vergata 1 , via della Ricerca Scientifica 1, 00133 Roma,

S

Setareh Fatemi

National Institute of Nuclear Physics (INFN), Unit of Pavia 2 , via A. Bassi 6, Pavia 27100,

L

Lorenzo Airoldi

Department of Chemistry, University of Pavia 3 , V.le Taramelli 12, Pavia I27100,

S

Silva Bortolussi

National Institute of Nuclear Physics (INFN), Unit of Pavia 2 , via A. Bassi 6, Pavia 27100,

M

Mattia Gaboardi

Physics Department and NAST Centre, Università degli Studi di Roma Tor Vergata 1 , via della Ricerca Scientifica 1, 00133 Roma,

M

Matthew Krzystyniak

A

Anna Marsicano

ISIS Neutron and Muon Source, Rutherford Appleton Laboratory 5 , Chilton OX11 0QX,

T

Triestino Minniti

Physics Department, Università degli Studi di Roma Tor Vergata 1 , via della Ricerca Scientifica 1, 00133 Roma,

I

Ignacio Porras

Department of Atomic, Molecular and Nuclear Physics, University of Granada 6 , Avenida de Fuentenueva S/N, CP:18071 Granada,

I

Ian Postuma

National Institute of Nuclear Physics (INFN), Unit of Pavia 2 , via A. Bassi 6, Pavia 27100,

R

Ricardo Ramos

National Institute of Nuclear Physics (INFN), Unit of Pavia 2 , via A. Bassi 6, Pavia 27100,

R

Roberto Senesi

Physics Department, Università degli Studi di Roma Tor Vergata 1 , via della Ricerca Scientifica 1, 00133 Roma,

U

Umberto Anselmi Tamburini

National Institute of Nuclear Physics (INFN), Unit of Pavia 2 , via A. Bassi 6, Pavia 27100,

V

Valerio Vercesi

National Institute of Nuclear Physics (INFN), Unit of Pavia 2 , via A. Bassi 6, Pavia 27100,

G

Giovanni Romanelli

Physics Department, Università degli Studi di Roma Tor Vergata 1 , via della Ricerca Scientifica 1, 00133 Roma,