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 841-852 of 9,538

Deriving General Energy Predictors for Pnictogen Bonding.

Langwald J, Frontera A

2026 PubMed Chemistry (Weinheim an der Bergstrasse, Germany)

Design and Characterization of Dual-Modal Fluorinated BODIPY Probes.

Ayaz N, Rosati M, Damoli M, Perez Rosas JC, Pizzi A, Metrangolo P, Orlandi S, Penconi M, Cavazzini M, Baldelli Bombelli F

2026 PubMed ChemPlusChem

Design and development of thiadiazole derived Schiff base as efficient corrosion inhibitor for steel materials: Experimental and quantum analysis

Naveenkumar C., Dileep R., Ranganatha S.

2026 Crossref Next Materials

Design and Evaluation of Gellan/Boron-dipyrromethene as a Photoactive Hydrogel and Efficiency as Antiyeast Activity.

Ghorai S, Ghorai P, Bera D, Pramanick S, Das S, Karmakar AJ, Ghosh D, Datta PK, Banik A, Ganguly J

2026 PubMed ACS applied bio materials

Design and implementation of Cs/GO/TiO(2) nanocomposite for controlling sulfamethoxazole.

Amin KS, Ghanem MS, Mahmoud MM, El-Srougy AG, Elhaes H, Ibrahim MA

2026 PubMed Scientific reports

Design of monolithic microcavities for enhancing organic quantum emitters

Tim Hebenstreit, Jaime Gimeno Balaguer, Fridtjof Betz, Felix Binkowski, Maja Colautti, Jan Renger, Costanza Toninelli, Sven Burger, Stephan Götzinger

2026 arXiv arXiv preprint

Design strategies for fluorene-skeleton near-infrared small-molecule dyes and their NIR-II imaging applications.

Han T, Sun J, Mu S, Huang Q, Liu X, Zhang H

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

Design, construction, and field evaluation of an intelligent solid-state voltage regulator for voltage profile improvement in low-voltage distribution networks.

Mikhak-Beyranvand M, Bastami H, Farhadian AH

2026 PubMed Scientific reports

Design, synthesis, and applications of Naphthalimide-based Mechanofluorophores for multimodal security encryption and anti-counterfeiting technologies.

Prabakaran K, Manivannan R, Jayasudha P, Son YA

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

Design, synthesis, and biological evaluation of a dichloro-substituted schiff base as an α-amylase inhibitor: structural, computational, and molecular dynamics, in-silico approaches.

Chakkarapani N, Velmurugan Y, Hemamalini M, Venkatachalam R

2026 PubMed Journal of biomolecular structure & dynamics

Design, synthesis, bioactivity, DFT, and molecular docking of 4-aminoantipyrine analogs as potential analgesic and anti-inflammatory agents.

Benabbes M, El Moutaouakil Ala Allah A, Ziraoui O, El-Mernissi R, El Baria MK, Benlabchir AA, El Menyiy N, Akhazzane M, Tüzün B, El Harti J, Lamsaouri J

2026 PubMed Computational biology and chemistry

Designable van der Waals Crystal for Artificial Neuronal Cell Mimicking.

Lee J, Kim G, Lee D, Son S, Seok H, Son S, Choi H, Kim G, Back G, Kim H, Park C, Ahn J, Je S, Im C, Cho J, Grzeszczyk M, Kim S, Go E, Shim H, Choi D, Kim M, Kim HU, Jang WJ, Kim T

2026 PubMed Advanced materials (Deerfield Beach, Fla.)