Quantum Chemistry

9,039 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 8845-8856 of 9,039

Structure and conformational properties of diacetyl sulfide in the gaseous and condensed phases explored by gas electron diffraction, single-crystal X-ray diffraction, vibrational spectroscopy, and quantum chemical calculations.

Romano RM, Della Védova CO, Downs AJ, Oberhammer H, Parsons S

2001 PubMed Journal of the American Chemical Society

Structure of the fluorosulfite anion: rotational disorder of SO(2)F(-) in the alkali metal fluorosulfites and crystal structures of alpha- and beta-CsSO(2)F.

Kessler U, van Wüllen L, Jansen M

2001 PubMed Inorganic chemistry

Transport and lifetime enhancement of photoexcited spins in GaAs by surface acoustic waves.

Sogawa T, Santos PV, Zhang SK, Eshlaghi S, Wieck AD, Ploog KH

2001 PubMed Physical review letters

Understanding the role of stereoelectronic effects in determining collagen stability. 1. A quantum mechanical study of proline, hydroxyproline, and fluoroproline dipeptide analogues in aqueous solution.

Improta R, Benzi C, Barone V

2001 PubMed Journal of the American Chemical Society

[A quantum chemical study of pi-back-donation bond and Raman intensity of 1 sigma + electronic state of Pt-CO molecule].

Wu D, Xu X, Ren B, Cao Z, Shi P, Tian Z

2000 PubMed Guang pu xue yu guang pu fen xi = Guang pu

[Photochemistry study on novel water soluble thioxanthone photoinitiators].

Qian Z, Wang J, Lin Y

2000 PubMed Guang pu xue yu guang pu fen xi = Guang pu

[Quantum chemical approach to radiation-induced DNA damage].

Aida M

2000 PubMed Seikagaku. The Journal of Japanese Biochemical Society

1,3-Heterocumulene-to-alkyne.

Fabian J, Krebs A, Schonemann D, Schaefer W

2000 PubMed The Journal of organic chemistry

193 nm photolysis of aromatic and aliphatic dipeptides in aqueous solution: dependence of decomposition quantum yield on the amino acid sequence.

Mulcahy M, McInerney JG, Nikogosyan DN, Görner H

2000 PubMed Biological chemistry

A fluorescence study of the interaction and location of (+)-totarol, a diterpenoid bioactive molecule, in model membranes.

Mateo CR, Prieto M, Micol V, Shapiro S, Villalaín J

2000 PubMed Biochimica et biophysica acta

Ab initio molecular dynamics studies on HIV-1 reverse transcriptase triphosphate binding site: implications for nucleoside-analog drug resistance.

Alber F, Carloni P

2000 PubMed Protein science : a publication of the Protein Society

Astronomical constraints on the cosmic evolution of the fine structure constant and possible quantum dimensions.

Carilli CL, Menten KM, Stocke JT, Perlman E, Vermeulen R, Briggs F, de Bruyn AG, Conway J, Moore CP

2000 PubMed Physical review letters