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 49-60 of 276
Computational Studies of Some Hydrazone Derivatives as Antibacterial Agent: DFT and Docking Methods
Abel Oyebamiji, B. Benjamin Adeleke, Ajibade Adejoro, Oyedeji Folashade
Constructing spin‐adiabatic states for the modeling of spin‐crossing reactions. I. A shared‐orbital implementation
Yunwen Tao, Zheng Pei, Nicole Bellonzi, Yuezhi Mao, Zhu Zou, Wanzhen Liang, Zhibo Yang, Yihan Shao
Controlling the nonadiabatic electron-transfer reaction rate through molecular-vibration polaritons in the ultrastrong coupling regime
Nguyen Thanh Phuc, Pham Quang Trung, Akihito Ishizaki
Cooper pair polaritons in cold fermionic atoms within a cavity
Amaury Dodel, Alexander Pikovski, Igor Ermakov, Marek Narozniak, Valentin Ivannikov, Haibin Wu, Tim Byrnes
Core-shell quantum dots coated with molecularly imprinted polymer for selective photoluminescence sensing of perfluorooctanoic acid.
Zheng L, Zheng Y, Liu Y, Long S, Du L, Liang J, Huang C, Swihart MT, Tan K
Correlation femtoscopy at NICA energies
Mikhaylov Konstantin, Batyuk Pavel, Kodolova Olga, Malinina Lyudmila, Nigmatkulov Grigory, Romanenko Gleb
Corrosion inhibition of X65 steel in sulfuric acid by two food flavorants 2-isobutylthiazole and 1-(1,3-Thiazol-2-yl) ethanone as the green environmental corrosion inhibitors: Combination of experimental and theoretical researches.
Tan B, Zhang S, Liu H, Guo Y, Qiang Y, Li W, Guo L, Xu C, Chen S
Creation of new medical drugs based on TRIZ and computer mathematical modeling
B Farber, A Martynov, I Kleyn
Crossover from Coulomb blockade to ballistic transport in InAs nanowire devices.
Wang LB, Pan D, Huang GY, Zhao J, Kang N, Xu HQ
Decomposition of 15 aromatic compounds in supercritical water oxidation.
Yang B, Cheng Z, Gao X, Yuan T, Shen Z
Demonstration of Minisuperspace Quantum Cosmology Using Quantum Computational Algorithms on IBM Quantum Computer
Anirban Ganguly, Bikash K. Behera, Prasanta K. Panigrahi
Density matrix based perturbative corrections for improved quantum simulation accuracy
T. D. Morris, Z. P. Parks, A. J. McCaskey, J. Jakowski, R. C. Pooser