Electronic and photophysical properties of an atomically thin bowl-shaped beryllene encapsulated inside the cavity of [6]cycloparaphenylene (Be

Journal

Physical chemistry chemical physics : PCCP
ISSN: 1463-9084
Titre abrégé: Phys Chem Chem Phys
Pays: England
ID NLM: 100888160

Informations de publication

Date de publication:
30 Aug 2023
Historique:
medline: 23 8 2023
pubmed: 23 8 2023
entrez: 23 8 2023
Statut: epublish

Résumé

Exotic metallic nanostructures are being intensely pursued for a myriad of applications, with ultrathin membranes currently at the heart of several investigations. The objective of the present study was to systematically assess the atom-by-atom encapsulation of Be in the molecular nanoring of [6]cycloparaphenylene ([6]CPP). Further, the study aimed to scrutinize the structure, stability, and properties of the encapsulated Be

Identifiants

DOI: 10.1039/d3cp01952g PMID: 37608746
pubmed: 37608746
doi: 10.1039/d3cp01952g
doi:

Types de publication

Journal Article

Langues

eng

Sous-ensembles de citation

IM

Pagination

23262-23276

Auteurs

Akanksha Ashok Sangolkar (AA)

Laboratory of Advanced Computation and Theory for Materials and Chemistry, Department of Chemistry, National Institute of Technology Warangal (NITW), Warangal, Telangana-506004, India. ravinder_pawar@nitw.ac.in.

Rama Krishna Kadiyam (RK)

Laboratory of Advanced Computation and Theory for Materials and Chemistry, Department of Chemistry, National Institute of Technology Warangal (NITW), Warangal, Telangana-506004, India. ravinder_pawar@nitw.ac.in.

Mohmmad Faizan (M)

Laboratory of Advanced Computation and Theory for Materials and Chemistry, Department of Chemistry, National Institute of Technology Warangal (NITW), Warangal, Telangana-506004, India. ravinder_pawar@nitw.ac.in.

Omshireesh Chedupaka (O)

Laboratory of Advanced Computation and Theory for Materials and Chemistry, Department of Chemistry, National Institute of Technology Warangal (NITW), Warangal, Telangana-506004, India. ravinder_pawar@nitw.ac.in.

Raghasudha Mucherla (R)

Laboratory of Advanced Computation and Theory for Materials and Chemistry, Department of Chemistry, National Institute of Technology Warangal (NITW), Warangal, Telangana-506004, India. ravinder_pawar@nitw.ac.in.
ORCID: 0000-0002-1710-9630

Ravinder Pawar (R)

Laboratory of Advanced Computation and Theory for Materials and Chemistry, Department of Chemistry, National Institute of Technology Warangal (NITW), Warangal, Telangana-506004, India. ravinder_pawar@nitw.ac.in.
ORCID: 0000-0002-2191-1749

Classifications MeSH