For field-like environmental gas monitoring and noninvasive illness diagnostics, effective
sensing materials with exceptional sensing capabilities of sensitive, quick detection of …

The detection of biomarkers is the future of non-invasive medical diagnosis and screening.
Discovery and identification of reliable disease specific volatile organic compounds is …

The efficient and selective detection of volatile organic compounds (VOCs) provides key
information for various purposes ranging from the toxicological analysis of indoor/outdoor …

In this research, the adsorption behavior of Fe-decorated porphyrin is investigated toward
ethionamide (EA) using Density Functional Theory (DFT) calculations. Total energies …

In the present work, the structure and electronic properties of Ti-, Cr-, Fe-, Ni-, Zn-, and Cu-
inserted in porphyrin-reduced C70 fullerenes (TM-PIC70Fs) and their interactions with the …

The field of organic-borne biomarkers has been gaining relevance due to its suitability for
diagnosing pathologies and health conditions in a rapid, accurate, non-invasive, painless …

Although carbon nanotubes (CNTs) are promising candidates for gas-sensing materials
owing to their high gas sensitivity and room-temperature operation, they suffer from poor …

Volatile organic compounds (VOCs) are emitted as gases from solids and liquids. A large
number of objects around us are always emitting VOCs into the atmosphere. VOC emission …

In this study, we analyze armchair stanene nanoribbons as excellent sensing substances for
the early diagnosis of lung cancer using density functional theory and the non-equilibrium …

This study investigated the adsorption of CO 2 molecules on transition metal ions (TM)
porphyrins induced carbon nanocone (TM-PICNC)(TM= Sc 2+, Ti 2+, V 2+, Cr 2+, Fe 2+, Co …