Quantum Chemistry

1,370 papers from Crossref

Quantum Chemistry Research Context

This Quantum Articles category organizes published quantum research papers so readers can browse focused work by topic, source, and year.

Showing 337-348 of 1,370

Mapping the synergistic effect of shape attributes and oxidative coating on the effective complex dielectric function in core-multishell quantum dots

K. Hasanirokh, A. Naifar

2026 Crossref Micro and Nanostructures

Marine alga-mediated facile green synthesis of highly stable antibacterial ZnS quantum dots: a selective fluorescent sensor for heavy metal ions

Debasish Borah, Puja Saikia, Jayashree Rout, Debika Gogoi, Ankita Das, Narendra Nath Ghosh, Piyush Pandey, Chira R. Bhattacharjee

2026 Crossref Journal of Materials Science

Mass-scaling of quantum tunnelling in hydrogen bonds: Analytical model and comparison with multidimensional potentials

Krishna Kingkar Pathak

2026 Crossref Chemical Physics

Mechanistic and topological insights into the Curtius rearrangement of N,N-dimethylcarbamoyl azide: A quantum chemical study

Marzie Rastaghi, Behzad Chahkandi, Ehsan Zahedi

2026 Crossref Journal of Molecular Graphics and Modelling

Mechanistic elucidation of substituted aniline adsorption and inhibition on mild steel in sulphuric acid: A quantum chemical and electrochemical convergence

Meenakshi Gupta, Mansi Y. Chaudhary, Prerna Bansal, Rajni Grover, Shramila Yadav

2026 Crossref Total Chemistry

Mechanistic insights into Safranin-O adsorption on mineral clay: A green valorisation approach supported by Quantum and Classical Molecular Simulation

AHNIN Chaimaa, AHROUCH Mohammadi, CHRAKA Anas, MUSA A. Said, BOUNAB Loubna, AOULAD OMAR Yassmina, DRAOUI Khalid, HADRI Mohamed

2026 Crossref Surface Science

Medicinal Plant-Derived Bioinspired Carbon Quantum Dots: From Precursor Chemistry to Precision Cancer Theranostics

Hubza Ruatt Khan, Humaira Yasmeen, Khalid Mujasam Batoo, Mostafa Kamal Masud, Noor Muhammad

2026 Crossref BioNanoScience

Mercaptoacetic acid functionalized-graphene quantum dots loaded with curcumin against triple-negative breast cancer and Molecular Docking analyses with VEGFA and Bcl-2

Hussein Aldweik, Pinar Sen, Dolunay Şakar, Serap Yalçin Azarkan, Muhsin Konuk

2026 Crossref Journal of Molecular Structure

Metal-free carbon quantum dots as photocatalyst for phosphonation of undirected heteroaryl compounds

Tong Yue, Jun-Bo Wang, Xin-Yue Wang, Ming-Yi Huang, Mo Zhang, Zhan-Hui Zhang

2026 Crossref Chinese Chemical Letters

Metal-organic framework-derived carbons coupled CdSe quantum dots for solar H2 production beyond visible region

Chien-Yi Wang, Yu-Chen Wei, Yu-Chang Lin, Sudhakar Narra, Chun-Yi Chen, Tso-Fu Mark Chang, Masato Sone, Ying-Chih Pu, Eric Wei-Guang Diau, Yan-Gu Lin, Cheng-Yu Wang, Yung-Jung Hsu

2026 Crossref Applied Catalysis B: Environment and Energy

Metal–Organic Framework [Ag <sub>24</sub> (trz) <sub>18</sub> ] <sup>6+</sup> as a Nanocarrier Agent for Ibuprofen Drug: A <scp>DFT</scp> Study

Juliana Cirino dos Santos, Osmair Vital de Oliveira, Antônio Francisco Cruz Arapiraca, José Divino dos Santos

2026 Crossref International Journal of Quantum Chemistry

Microwave-assisted synthesis of nitrogen and sulfur co-doped carbon quantum dots from rice straw for fluorescent detection of Fe3+ in aqueous media

Thi Thao Vu, Thi Hoa Hoang, Bao Long Hoang, Hop Bao Tung Nguyen, Duc Cuong Nguyen

2026 Crossref Journal of Photochemistry and Photobiology A: Chemistry