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 8893-8904 of 9,538
Silica nanoparticles encapsulating near-infrared emissive cyanine dyes.
Bringley JF, Penner TL, Wang R, Harder JF, Harrison WJ, Buonemani L
Simple replacement of violaxanthin by zeaxanthin in LHC-II does not cause chlorophyll fluorescence quenching.
Dreuw A, Wormit M
Simulation of tunneling in enzyme catalysis by combining a biased propagation approach and the quantum classical path method: application to lipoxygenase.
Mavri J, Liu H, Olsson MH, Warshel A
Size-dependent Fano Interaction in the Laser-etched Silicon Nanostructures
Kumar Rajesh, Shukla AK, Mavi HS, Vankar VD
Spectral features of substituted 9-(phenoxycarbonyl)-acridines and their protonated and methylated cation derivatives.
Krzymiński K, Roshal AD, Niziołek A
Spectroscopic investigations of a novel tricyanofuran dye for nonlinear optics.
Han L, Jiang Y, Li W, Li Y, Hao P
Structure and electronic properties of "DNA-gold-nanotube" systems: a quantum chemical analysis.
Pannopard P, Khongpracha P, Probst M, Limtrakul J
Structure, spectra and stability of a tetrafluoromethane-water complex.
Mierzwicki K, Mielke Z, Sałdyka M, Coussan S, Roubin P
Structures and vibrational frequencies of 2-naphthoic acid and 6-bromo-2-naphthoic acid based on density functional theory calculations.
Krishnakumar V, Mathammal R, Muthunatesan S
Studies on electron spin resonance spectroscopy of biradical molecules containing (14)N-O and (15)N-O moieties.
Kameya H, Nakamura H, Ukai M, Shimoyama Y
Study by optical spectroscopy and molecular dynamics of the interaction of acridine-spermine conjugate with DNA.
Sánchez-Carrasco S, Delcros JG, Moya-García AA, Sánchez-Jiménez F, Ramírez FJ
Study of the absorption and emission spectroscopy of "A-B" type photosensitive compounds including two-photon chromophore and benzophenone moiety.
Gao F, Hu N, Xie T, Cheng Z, Yang L, Liu X, Li Z, Wang X, Li H, Li X