A computational investigation towards substitution effects on 8π electrocyclisation of conjugated 1,3,5,7-octatetraenes
A computational investigation using M06-2X/6-31+G(d) method is reported for the substitution effects on 8π electrocyclisation of …
The domination number of the king’s graph
For a graph Γ , a subset S⊆ VΓ is known to be a dominating set, if every x∈ VΓ S has at least one neighbor in D. The domination number …
Sustainable Valorization of Wood Residue for the Production of Biofuel Materials Via Continuous Flow Hydrothermal Liquefaction
When forests are extensively cleared for infrastructure and agricultural purposes, over half of the wood generated is regarded as …
Subcritical Water Hydrolysis of Cotton Fibers to Nanocellulose for Producing Poly(vinyl alcohol)/Cellulose Biocomposite
Cellulose nanofibers (CNs) are isolated from cotton wool using subcritical water in a semiflow hydrothermal reactor to achieve green …
Statistical significance of valency-based topological descriptors for correlating thermodynamic properties of benzenoid hydrocarbons with applications
This paper employs valency descriptors to investigate their predictive potential for determining thermodynamic properties of benzenoid …