Quantum Chemistry

9,662 papers

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 2437-2448 of 9,662

Optimizing cross-domain transfer for universal machine learning interatomic potentials.

Kim J, You J, Park Y, Lim Y, Kang Y, Kim J, Jeon H, Ju S, Hong D, Lee SY, Choi S, Kim Y, Lee JW, Han S

2026 PubMed Nature communications

Optimizing design and exploring the dual potential of carbon quantum dots in environmental sensing and biomedical theranostics

Govindaraj Sabarees

2026 Crossref Nano Biomedicine and Engineering

Optimizing Effective Potentials via Gradient-Enhanced Surrogates for Quantum Embedding

Elijah Begin, Chong Teng, Junwei Lucas Bao

2026 Crossref Journal of Chemical Theory and Computation

Optimizing ground state preparation protocols with autoresearch

Luis Mantilla Calderón, Jérôme F. Gonthier, Ignacio Gustin, Varinia Bernales, Alán Aspuru-Guzik

2026 arXiv arXiv preprint

Optimizing resource allocation for accuracy in noisy variational quantum algorithms

Harshit Verma, Thomas Ayral, Alexia Auffèves, Robert Whitney

2026 arXiv arXiv preprint

Optimizing Subspace Expansion in Quantum Chemistry through Operator Selection and Reference State Choice

Konstantin Lamp, Alejandro D. Somoza, Elias Walter, Marina Walt, Michael Marthaler, Maria Fernanda Juarez, Birger Horstmann

2026 arXiv arXiv preprint

Optimum-Transmission Free-Space Optical Communications

Prajit Dhara, Babak N. Saif, Jeffrey H. Shapiro, Saikat Guha

2026 arXiv arXiv preprint

Optoelectronic Characterization of Trap Density of States in Indium Gallium Oxide Thin-Film Transistors and Their Impact on Bias Stability.

Kim SY, Lee JJ, Hur JS, Kim B, Hong JP, Han SJ, Yeon E, Kim JW, Jeong JK, Hwang DK

2026 PubMed ACS applied materials & interfaces

Optoelectronic Enhancement in Nanostructured h‑BN Synthesized Using Pulsed Ultrasonication.

Tony A, Mahato R, Bhaumik A

2026 PubMed ACS omega

Oral Administration of Berberine-Based Carbon Dots Target Ferric Iron to Alleviate Atherosclerosis.

Li X, Wang Y, Chen C, Jiang S, Yu Z, Gao Y, Chen Y, Yang X, Li B, Qin L, Fan J, Li L, Wang G

2026 PubMed ACS applied materials & interfaces

Orbital Hall Effect in Weyl Semimetals from quantum geometric band interference

Chiara Pacella, Maximilian Ünzelmann, Ahmed Osman, Tim Figgemeier, Friedrich Reinert, Angel Rubio, Domenico Di Sante

2026 arXiv arXiv preprint

Orbital Surface Hopping with an Electron Thermostat Yields Accurate Dynamics and Detailed Balance.

Ma YT, Dou W

2026 PubMed Journal of chemical theory and computation