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 2761-2772 of 3,656
Magnetoencephalography: From SQUIDs to neuroscience. Neuroimage 20th anniversary special edition.
Hari R, Salmelin R
Microbial processing of tellurium as a tool in biotechnology.
Turner RJ, Borghese R, Zannoni D
Molecular mechanics modeling of azobenzene-based photoswitches.
Duchstein P, Neiss C, Görling A, Zahn D
New strategy of efficient inhibition of cancer cells by carborane carboxylic acid-CdTe nanocomposites.
Wu C, Shi L, Li Q, Jiang H, Selke M, Yan H, Wang X
Nitryl chloride (ClNO2): UV/vis absorption spectrum between 210 and 296 K and O(3P) quantum yield at 193 and 248 nm.
Ghosh B, Papanastasiou DK, Talukdar RK, Roberts JM, Burkholder JB
Oxygenation of the phenylhalocarbenes. Are they spin-allowed or spin-forbidden reactions?
Lamsabhi AM, Corral I, Pérez P, Tapia O, Yáñez M
Photochemistry and photophysics of n-butanal, 3-methylbutanal, and 3,3-dimethylbutanal: experimental and theoretical study.
Tadić JM, Moortgat GK, Bera PP, Loewenstein M, Yates EL, Lee TJ
Photoisomerization of alfa calcidol by a sensitized quantum chain reaction.
Estruch GA, Aramendía PF
Photosynthetic characteristics of marine aerobic anoxygenic phototrophic bacteria Roseobacter and Erythrobacter strains.
Sato-Takabe Y, Hamasaki K, Suzuki K
Polarization-induced σ-holes and hydrogen bonding.
Hennemann M, Murray JS, Politzer P, Riley KE, Clark T
Polyphenol fatty acid esters as serine protease inhibitors: a quantum-chemical QSAR analysis.
Viskupicova J, Danihelova M, Majekova M, Liptaj T, Sturdik E
Prediction of hydration free energies for aliphatic and aromatic chloro derivatives using molecular dynamics simulations with the OPLS-AA force field.
Beckstein O, Iorga BI