Computation of atomic electronegativity values using atomic and covalent potential: a FSGO based study

DOI10.1007/S10910-022-01376-1zbMath1500.81087OpenAlexW4283454592MaRDI QIDQ2160348

Martín Labarca, Dimple Kumari, Tanmoy Chakraborty, Hiteshi Tandon, Kumari Saloni

Publication date: 3 August 2022

Published in: Journal of Mathematical Chemistry (Search for Journal in Brave)

Full work available at URL: https://doi.org/10.1007/s10910-022-01376-1

zbMATH Keywords

atomic potentialFermi energyelectronegativityelectronegativity equalization principlecovalent potentialFSGO approachinternuclear bond distance

Mathematics Subject Classification ID

Nuclear physics (81V35) Electromagnetic interaction; quantum electrodynamics (81V10) Atomic physics (81V45) Orbital mechanics (70M20) Fermionic systems in quantum theory (81V74)

Related Items (2)

Application of floating spherical Gaussian orbital approach in redefining the atomic periodic descriptor ⋮ Covalent organic frameworks: topological characterizations, spectral patterns and graph entropies

Uses Software

• GAUSSIAN

Cites Work

• Atomic electronegativity based on hardness and floating spherical Gaussian orbital approach

This page was built for publication: Computation of atomic electronegativity values using atomic and covalent potential: a FSGO based study