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 8281-8292 of 9,538
Theoretical investigation of the two-photon absorption properties of 3,6-bis(4-vinylpyridinium) carbazole derivatives--new biological fluorescent probes.
Sun Y, Zhao Y, Liu XT, Ren AM, Feng JK, Yu XQ
2012
PubMed
Journal of molecular modeling
Theoretical studies on the structures and detonation properties of nitramine explosives containing benzene ring.
Zhao G, Lu M
2012
PubMed
Journal of molecular modeling
Theoretical study of the local reactivity of electrophiles of the type MPR3(+) (M = Cu, Ag, Au; R = -H, -Me, -Ph).
Burgos D, Olea-Azar C, Mendizabal F
2012
PubMed
Journal of molecular modeling
Theory of vibronic assistance in the nonequilibrium condensation of exciton polaritons in optically--pumped organic single crystal microcavities
Eric R. Bittner, Svitlana Zaster, Carlos Silva
2012
arXiv
arXiv preprint
Time-dependent quantum dynamical simulations of C2 condensation under extreme conditions.
Jakowski J, Irle S, Morokuma K
2012
PubMed
Physical chemistry chemical physics : PCCP
Toward quantum simulations of biological information flow
Ross Dorner, John Goold, Vlatko Vedral
2012
arXiv
arXiv preprint
Towards quantum simulations of biological information flow.
Dorner R, Goold J, Vedral V.
2012
Europe PMC
Interface Focus
Transport behavior of selected nanoparticles with different surface coatings in granular porous media coated with Pseudomonas aeruginosa biofilm.
Tripathi S, Champagne D, Tufenkji N
2012
PubMed
Environmental science & technology
Triple-quantum-filtered sodium imaging of the human brain at 4.7 T.
Tsang A, Stobbe RW, Beaulieu C
2012
PubMed
Magnetic resonance in medicine
Why is the crystal shape of TATB is so similar to its molecular shape? Understanding by only its root molecule.
Zhang C, Kang B, Cao X, Xiang B
2012
PubMed
Journal of molecular modeling
A classical master equation for excitonic transport under the influence of an environment
A. Eisfeld, J. S. Briggs
2011
arXiv
arXiv preprint
A density functional theory for studying ionization processes in water clusters.
Livshits E, Granot RS, Baer R
2011
PubMed
The journal of physical chemistry. A