Capturing Correlation Effects in Positron Binding to Atoms and Molecules

S Upadhyay, A Benali, KD Jordan - Journal of Chemical Theory …, 2024 - ACS Publications
A major challenge in contemporary electronic structure theory involves the development of
methods to describe in a balanced manner the contribution of correlation effects to energy …

Does Positron Attachment Take Place in Water Solution?

M Bergami, J Charry, A Reyes, K Coutinho… - The Journal of …, 2024 - ACS Publications
We performed a computational study of positron attachment to hydrated amino acids,
namely glycine, alanine, and proline in the zwitterionic form. We combined the sequential …

Theoretical Treatment of Weakly Bound Fermions to Atoms, Molecules, and Clusters

S Upadhyay - 2023 - search.proquest.com
Certain atoms, molecules, and clusters can bind an excess electron or positron in a diffuse
orbital. Given the weak binding energy of these states, usually on the order of tens to …

Chemistry and physics of positrons interacting with atoms, molecules, and fields

JA CHARRY MARTINEZ - 2023 - orbilu.uni.lu
The positron is the antiparticle of the electron, possesing the same mass and obeying the
same spin statistics but with an opposite charge. When a positron and an electron collide …

[PDF][PDF] Reações positrônicas em solução

MB Rocha, MTN Varella - 2024 - teses.usp.br
RESUMO Pósitrons e átomos de positrônio sao conhecidos por serem excelentes sondas
em nanoescala amplamente utilizadas em ciência de materiais e na medicina. Essas …

Towards computacional models for positronium in complex chemical environments

M Bergami, LB Martins, K Coutinho, J Charry, A Reyes - fisica.ufpr.br
Positron annihilation lifetime spectroscopy (PALS) is widely used in materials sciences to
investigate conformational, structural, and microenvironmental properties of biomimetic …

[CITATION][C] Átomos de Positrônio em Meios Condensados

LB Martins, M Bergami, A Reyes, K Coutinho