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 3037-3048 of 3,656
Quantum chemical studies of the adsorption of single acetone molecules on hexagonal ice I(h) and cubic ice I(c).
Somnitz H
Rapid peptide fragmentation without electrons, collisions, infrared radiation, or native chromophores.
Yeh GK, Sun Q, Meneses C, Julian RR
Role of oxygen active species in the photocatalytic degradation of phenol using polymer sensitized TiO2 under visible light irradiation.
Zhang D, Qiu R, Song L, Eric B, Mo Y, Huang X
S K-edge NEXAFS spectra of model systems for SO2 on TiO2 (110): a TDDFT simulation.
De Francesco R, Stener M, Fronzoni G
Scaled quantum chemical calculations and FTIR, FT-Raman spectral analysis of 2-Methylpyrazine.
Krishnakumar V, Prabavathi N
Self-assembly drives quantum dot photoluminescence.
Plain J, Sonnefraud Y, Viste P, Lérondel G, Huant S, Royer P
Semisynthesis and segmental isotope labeling of the apoE3 N-terminal domain using expressed protein ligation.
Hauser PS, Raussens V, Yamamoto T, Abdullahi GE, Weers PM, Sykes BD, Ryan RO
SERRS coded nanoparticles for biomolecular labelling with wavelength-tunable discrimination.
McKenzie F, Ingram A, Stokes R, Graham D
Size-dependent electrochemiluminescence behavior of water-soluble CdTe quantum dots and selective sensing of l-cysteine.
Hua L, Han H, Zhang X
Sizing, stoichiometry and optical absorbance variations of colloidal cadmium sulphide nanoparticles.
Stebbing SR, Hughes RW, Reynolds PA
Structure and reactivity of TNT and related species: application of spectroscopic approaches and quantum-chemical approximations toward understanding transformation mechanisms.
Qasim M, Gorb L, Magers D, Honea P, Leszczynski J, Moore B, Taylor L, Middleton M
Surface chemistry and photophysical properties of a diacetylene-peptide derivative capped quantum dots Langmuir monolayer.
Xu J, Wang C, Leblanc RM