Quantum Chemistry

9,538 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 1213-1224 of 9,538

Evaluating MS-ANI vs SS-ANI for Surface Hopping Simulations: A Cyclohexadiene Photochemical Ring-Opening Case Study.

Medhi B, Morang M, Sarma M

2026 PubMed The journal of physical chemistry letters

Evaluation of a Hybrid Fertilizer Based on Hydroxyapatite Nanoparticles Supported on Zeolite in a Tomato Crop

Estrella K. Hernández-Vázquez, María de la L. Guerrero-González, José M. Guzmán-Palomino, María Fernanda Quintero-Castellanos, Erika Padilla-Ortega, Pablo Delgado-Sánchez

2026 OpenAlex Horticulturae

Evaluation of acrylate and epoxy photopolymers used in 3D printing for chemical compatibility with trace atomic spectroscopy applications.

Rweyemamu AR, Bélteki Á, Kajner G, Urbán O, Cseh M, Geretovszky Z, Janovák L, Galbács G

2026 PubMed Talanta

Evaluation of chemical reactivity and molecular affinity of Lignosulfonic acid sodium salt in deep eutectic solvent using quantum chemical calculations

Nithya Shree Harikumar, Anantharaj Ramalingam

2026 Crossref Journal of Molecular Liquids

Evaluation of near-infrared two-photon absorption response and excited state dynamics of asymmetric aza-BODIPY derivatives.

Doğan A, Yılmaz H, Yıldız EA, Sevinç G, Arı F, Unver H, Boyacioglu B, Hayvali M, Elmali A, Karatay A

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

Evaluation of photon fluxes, external mass transfer and heterogeneous quantum yield in an Optofluidic threaded microreactor (OTM)

Amparo Fernández-Pérez, Gregorio Marbán

2026 Crossref Journal of Photochemistry and Photobiology A: Chemistry

Evaluation of quantum offset in velocity imaging-based electron spectrometry

Rui Zhang, Shuaiting Yan, Wenru Jie, Jiayi Chen, Qihan Liu, Chuangang Ning

2026 Crossref The Journal of Chemical Physics

Evidence for cavity-induced metallic phase from entropic electron correlation effects

Jacob Horak, Dominik Sidler

2026 arXiv arXiv preprint

Evidence for Photoinduced Polaron Generation in a High Persistence Length Low Bandgap Conjugated Polymer in Solution.

Azzouzi M, Rezasoltani E, Bird MJ, Coker JF, Frost JM, LeCroy GS, Parker AW, Sazanovich IV, Greetham GM, Towrie M, Virbule A, Vezie MS, Heracleous D, Bronstein H, Salleo A, Nelson J, Hayes SC

2026 PubMed The journal of physical chemistry. B

Evidence from computational infrared spectroscopy against vibrational detection of propionate by human olfactory receptor OR51E2.

Williams JZ, Marszalek PE, Yang W

2026 PubMed European biophysics journal : EBJ

Evidence of static quenching in the photoredox activity of perylene diimide radical anions: implications for consecutive photoinduced electron transfer photocatalysis.

Sucre-Rosales E, Cruz Neto DH, Vauthey E

2026 PubMed Chemical science

Evolution of electronic and magnetic properties in Mn- and Co-alloyed ferromagnetic kagome metal Fe3Sn2

Prajwal M. Laxmeesha, Rajesh Dutta, Rajeev Kumar Rai, Sharup Sheikh, Michael F. DiScala, Uditha M. Jayathilake, Alexander Velič, Tarush Tandon, Tessa D. Tucker, Christoph Klewe, Haile Ambaye, Timothy Charlton, Tien-Lin Lee, Eric A. Stach, Kemp W. Plumb, Alexander X. Gray, Steven J. May

2026 DOAJ APL Materials