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 1081-1092 of 9,662

Efficient near-infrared-to-visible quantum dot up-conversion device using a hybrid planar/bulk heterojunction

Kuibao Yu, Hailong Hu, Zhihan Lin, Chao Zhong, Fushan Li

2026 Crossref Materials Today

Efficient Photocatalytic H(2)O(2) Production in a Quasi-Homogeneous System Utilizing Conjugated Polymer Nanoparticles.

Tong Y, Lu Y, Tian Y, Luo J, Jiang Y, Zhao C, Wu W

2026 PubMed Small (Weinheim an der Bergstrasse, Germany)

Efficient Prediction of Transition-Metal NMR Chemical Shifts Using Machine Learning: Do Two-Dimensional Descriptors Suffice?

Isaev YI, Kovalev AE, Ksenofontov AA, Makarov DM, Khodov IA

2026 PubMed Journal of chemical information and modeling

Efficient pure-red multiple resonance emitter based on a donor planarization strategy.

Li L, Xu Y, Zhang D, Qu Y, Wang Y, Li C

2026 PubMed Chemical science

Efficient QM/MM Modeling of Enzymatic Reactions Combining PathCV with OPES.

Rivas-Fernández JP, Calvelo M, Sagiroglugil M, Liao Q, Rovira C

2026 PubMed Journal of chemical theory and computation

Efficient Red/Green Inverted Quantum-Dot Light-Emitting Diodes Enabled by Bilateral Heterojunction Charge-Generation Layers

Boyu Zhou, Yixian Wu, Zehua Zheng, Xinwei Zhang, Yanping Wang

2026 Crossref Nano Letters

Efficient removal of antibiotics from wastewater by a low-cost olive leaf biosorbent: Thermodynamics, kinetics and quantum chemical studies

Rasheed M. A. Q. Jamhour, Ashraf M. Al-Msiedeen, Haneen A. Al-Safasfeh, Samer Alawaideh, Firas Khalil Al-Zeidaneen, Noureddine El Messaoudi

2026 Crossref Journal of King Saud University – Science

Efficient Simulation of Pre-Born-Oppenheimer Dynamics on a Quantum Computer

Matthew Pocrnic, Ignacio Loaiza, Juan Miguel Arrazola, Nathan Wiebe, Danial Motlagh

2026 arXiv arXiv preprint

Efficient Sky-Blue Narrow-Band Thermally Activated Delayed Fluorescence Emitters Integrating Charge-Transfer and Multiple-Resonance Character Based on Indolocarbazole.

Li X, Xu H, Wei Z, Liu T, Du Y, Miao Y, Tao P, Wang H

2026 PubMed The journal of physical chemistry letters

Efficient spin-doublet near-infrared emission beyond 800 nm via intramolecular charge transfer in a quasi-planar donor-acceptor structure.

Xiang L, Yu S, Ji X, Chen Y, Yan Y, Feng J, Yu YJ, Zhang H, Zhang M, Li F

2026 PubMed Chemical communications (Cambridge, England)

Efficient synthesis of Co3O4 quantum dots embedded ZIF-67 nanocomposite: A promising electrocatalyst for oxygen evolution reaction

Anindita Chakraborty, Debashis Kundu

2026 Crossref International Journal of Hydrogen Energy

Efficient targeting of arbitrary excited states with quantum inverse power iteration through filtering polynomials

Srushti Patil, Nina Glaser

2026 arXiv arXiv preprint