Quantum Chemistry
276 papers for year 2019
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 85-96 of 276
Exciton Interferometry
Ariel Shlosberg, Mark T. Lusk
Experimentally demonstration of the repulsive Casimir force in the gold-cyclohexane-PTFE system
Qian Hu, Jianhua Sun, Qian Zhao, Yonggang Meng
Exploring PfDHFR reaction surface: A combined molecular dynamics and QM/MM analysis.
Abbat S, Jaladanki CK, Bharatam PV
Extended dynamically weighted CASPT2: the best of two worlds
Stefano Battaglia, Roland Lindh
Extrapolation of phenolic compounds as multi-target agents against cancer and inflammation.
Kumar N, Gupta S, Chand Yadav T, Pruthi V, Kumar Varadwaj P, Goel N
Fermentative Metal – Containing Bio-Nano complexes, Quantum Chemical Models of Their Active Centers and Applications in Biotechnologies
Uvarova Ludmila, Romanova Ekaterina, Korobov Nikolai, Obukhova Elena, Krasikova Ekaterina
First-principles-based reaction kinetics from reactive molecular dynamics simulations: Application to hydrogen peroxide decomposition.
Ilyin DV, Goddard WA 3rd, Oppenheim JJ, Cheng T
Formation of CdSe quantum dots from single source precursor obtained by thermal and laser treatment
Francesca Limosani, Rocco Carcione, Francesco Antolini
Framework for simulating gauge theories with dipolar spin systems
Di Luo, Jiayu Shen, Michael Highman, Bryan K. Clark, Brian DeMarco, Aida X. El-Khadra, Bryce Gadway
Free-standing silicon shadow masks for transmon qubit fabrication
I. Tsioutsios, K. Serniak, S. Diamond, V. V. Sivak, Z. Wang, S. Shankar, L. Frunzio, R. J. Schoelkopf, M. H. Devoret
Generalized input-output method: A new route to quantum transport junctions
Junjie Liu, Dvira Segal
Generalized quantum cumulant dynamics
J. J. Bowen, M. J. Everitt, I. W. Phillips, V. M. Dwyer