Quantum Chemistry
3,656 papers from PubMed
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 1753-1764 of 3,656
Red-shifting squaraine dyes in the near-infrared region using perimidine heterocycles: synthesis and optical properties.
Sarasiya S, Henary M
Red-to-Blue Photon Upconversion Based on BODIPY Derivative Photosensitizers.
Wu Y, Song B, Shao J, Cheng J, Li Y, Chen L, Wei Y, Xu X
Reduced dynamical maps in finite temperature vibronic coupling models via Choi matrices: Numerical methods and applications.
Borrelli R, Takahashi H
Reduced geomagnetic field modulates photosynthetic electron flow, menthol yield, flavonoid photoprotection and ROS homeostasis in peppermint (Mentha × piperita L.).
Mannino G, Caldo F, Maffei ME
Reductant-Activated Indium Phosphide Magic-Sized Clusters for Dual-Path Synthesis of Bright Blue Emitters and Narrow-Band Quantum Dots.
Huang Y, Zhang H, Zhu Y, Hu J, Zhao Z, Yang Y, Tang J, Du Z
Reevaluating Valence-Shell Electron Pair Repulsion and Hybrid Atomic Orbitals in Chemical Education.
Thomasi SS, Silva PRD, Freitas MP
Reference-Free Structure Elucidation of N-O Heterocyclic Ring Systems with Infrared Ion Spectroscopy: A Test Case of the Isoxazoline Insecticide Isocycloseram and Its MS/MS Fragment.
van Wieringen T, Chantzis A, Oomens J, Berden G, Saeed M, Perry SJ, Martens J
Refractory to Improvement: A Cautionary Tale of Two-Electron Densities Computed with One-Electron Basis Sets and of Their Employment in Quantum-Chemical Formalisms.
Cioslowski J, Domin J, Matito E
Regioselective Halogenation of BOPPY Fluorophores and Subsequent Diversification via Cross-Coupling and Aromatic Nucleophilic Substitution Strategies.
Oloo SO, Bobadova-Parvanova P, Lueders AA, Kim M, Fronczek FR, Smith KM, Vicente MDGH
Regulating Noncovalent Interactions to Construct High-Temperature Multiaxial Lead-Free Metal Halide Hybrid Ferroelectrics.
Fu D, Wang Q, Wu S, Zhao R, Chen S, Jia W, Wu Z, He Y, Li X, Mao X, Xu J, Fu DW, Luo J
Regulating the d-band center of tungsten‑molybdenum bimetallic alloys via incomplete carbon coating for enhanced proton dissociation and the photocatalytic hydrogen evolution of transition metal sulfides.
Miao RZ, Zhang YD, Chai WH, Sun YJ, Wang XJ, Luo X, Mu HY, Yang J, Li FT
Regulation of Energy and Mass Transport in a Hydrogen-Bonded Framework for Visible-Light-Driven CO(2) Reduction in Water.
Xu J, Zhang X, Ma L, Wu T, Wang H, Deng Y, Xia J, Qiu Z, Sun K, He A, Zhang J, Zhang X, Chen B