Cargando…

Electron density mapping of boron clusters via convolutional neural networks to augment structure prediction algorithms

Determination and prediction of atomic cluster structures is an important endeavor in the field of nanoclusters and thereby in materials research. To a large extent the fundamental properties of a nanocluster are mainly governed by its molecular structure. Traditionally, structure elucidation is ach...

Descripción completa

Detalles Bibliográficos
Autores principales: Saha, Pinaki, Nguyen, Minh Tho
Formato: Online Artículo Texto
Lenguaje:English
Publicado: The Royal Society of Chemistry 2023
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10586239/
https://www.ncbi.nlm.nih.gov/pubmed/37869387
http://dx.doi.org/10.1039/d3ra05851d