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 5461-5472 of 9,538
Theoretical Exploitation of 1,2,3,4,5,6-Hexachloro- and 1,2,3,4,5,6-Hexafluorocyclohexane Isomers as Biologically Active Compounds.
Martins FA, Freitas MP
Theoretical investigation on the reaction mechanisms of <scp>O<sub>2</sub></scp>‐initiated gas‐phase oxidation of lignin model compounds
Shuqi Dong, Hui Zhang, Xia Du, Tingyu Yao, Yan Shang, Liquan Jing, Jinguang Hu
Theoretical study of physisorption of tosylate on AU10, AU15 and AU18 surfaces utilizing DFT approach
Fatima Thamer, Abbas Shwya
Theoretical Study on the Open-Shell Electronic Structure and Electron Conductivity of [18]Annulene as a Molecular Parallel Circuit Model
Naoka Amamizu, Mitsuhiro Nishida, Keisuke Sasaki, Ryohei Kishi, Yasutaka Kitagawa
Theoretical study on the origin of the dual phosphorescence emission from organic aggregates at room temperature.
Li Q, He Y, Lv K, Ma H
Theoretical study on the vibrational spectra and potential energy curves for SiC (X(3)Π) and SiS (X(1)Σ(+)) molecules.
Fan Q, Tian H, Fan Z, Li H, Fu J, Ma J, Xie F
Theory of spatially indirect excitons in nanosystems containing double semiconductors quantum dots
Chuiko Institute of Surface Chemistry of National Academy of Sciences of Ukraine, S. I. Pokytnii, A. D. Terets, Chuiko Institute of Surface Chemistry of National Academy of Sciences of Ukraine
Theory of weak localization in graphene with spin-orbit interaction
L. E. Golub
Thermal effects in an imbalanced dipolar fermionic superfluid
Subhanka Mal, Hiranmaya Mishra, Prasanta K. Panigrahi, Bimalendu Deb
Three-dimensional harmonic oscillator as a quantum Otto engine
Aleksandr Rodin
Three-photon electron spin resonances
S. I. Atwood, V. V. Mkhitaryan, S. Dhileepkumar, C. Nuibe, S. Hosseinzadeh, H. Malissa, J. M. Lupton, C. Boehme
Time dependent Vibrational Electronic Coupled Cluster (VECC) theory for non-adiabatic nuclear dynamics
Songhao Bao, Neil Raymond, Marcel Nooijen