Quantum Chemistry

8,661 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 2293-2304 of 8,661

Significant phase deviation of magnetic quantum oscillations induced by magnetic impurities

Sang-Eon Lee, Sanghyun Ji, Junhee Park, Munir Humayun, Myung-Hwa Jung

2026 Crossref NPG Asia Materials

Significantly improved optoelectronic properties of WWC-103 engineered for efficient perovskite solar cells: A DFT approach.

Yaqoob U, Rafiq S, Sabir MZ, Ayub AR, Salba, Anwer M, Parveen A

2026 PubMed Journal of molecular graphics & modelling

Silk fibroin loaded carbon point-chlorogenic acid complex hydrogel for photothermal/antioxidant therapy of diabetic wound.

Zhao Y, Shi X, Hou S, Zhang W, Yang K, Gui L, Zhao Z, Ge F

2026 PubMed Colloids and surfaces. B, Biointerfaces

Simplified Time-Dependent DFT for all-Atom Simulations of Second Harmonic Generation Responses: A Case Study on Photoswitchable Azobenzene Monolayers.

Hugget M, Dellai A, Aurel P, Maraldi MG, de Wergifosse M, Castet F

2026 PubMed Journal of computational chemistry

Simulating enzyme catalysis with electrostatically embedded machine learning potentials.

Gradisteanu V, Chan EW, Hedges L, Malagarriga M, David R, de la Puente M, Laage D, Tuñón I, van der Kamp MW, Zinovjev K

2026 PubMed Chemical science

Simulating Supersymmetric Quantum Mechanics Using Variational Quantum Algorithms

John Kerfoot, David Schaich, Emanuele Mendicelli

2026 arXiv arXiv preprint

Simulation of the interaction mechanisms of the outer surface of albumin with platinum(II) complexes

M.V. Sydorenko, E.M. Demianenko, N. V. Siharova, N.Yu. Pershko, S.V. Zhuravskyi, A.D. Terets

2026 OpenAlex Himia Fizika ta Tehnologia Poverhni

Simulation-guided design of peptide-metal coordination interfaces for next-generation metallo-immunotherapy.

Jang Y, Bellier N, Canlas KKV, Lee JY, Kim Y, Park H, Moon JJ

2026 PubMed Nano convergence

Simultaneous detection of methane and carbon dioxide in human exhalation based on photoacoustic spectroscopy.

Sun C, Wang C, Shen X, Feng C, Xie X, Shi L, Cui R, Dai J, Wang Y, Giglio M, Sampaolo A, Patimisco P, Xiao L, Spagnolo V, Yin X, Dong L, Wu H

2026 PubMed Photoacoustics

Simultaneous determination of amoxicillin and clavulanic acid using MPA-capped AgInS₂ quantum dots: A fluorescence-based chemometric approach.

Castro RC, Páscoa RNMJ, Santos JLM, Ribeiro DSM

2026 PubMed Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy

Simultaneous Dissolved Gas Analysis in Transformer Oil via Time-Division-Multiplexed Quartz-Enhanced Photoacoustic Spectroscopy.

Dai J, Zhang Y, Wang J, Wang C, Wang Y, Tian Q, Chen Y, Feng C, Cui R, Yin X, Dong L, Wu H

2026 PubMed Analytical chemistry

Simultaneous Fragment Docking for Geometrically Linkable Pose Pairs

Jiyun Lee, You Kyoung Chung, Joonsuk Huh

2026 arXiv arXiv preprint