Quantum Simulation
709 papers from PubMed
Quantum Simulation Research Context
This category collects papers on quantum simulation methods for chemistry, materials, many-body systems, condensed matter, and physics models.
Showing 85-96 of 709
Clarifying NH2 + O(3P) reaction dynamics: A full-dimensional MRCI, machine-learned PES unravels high-temperature kinetics.
Xing Y, Hua W, Zuo J
Clarifying Photodetachment in Al(13)(-) Anions and Photoionization in Al(13) Neutrals Using Diffusion Monte Carlo.
Chiong MR 3rd, Nakajima A, Morikawa Y
Coarse-Grained Mapping of Fluid Particles via Evolutionary Fuzzy Clustering: Membership-Evolution Term as a Pressure Correction Mechanism.
Han J, Feng Y, Wu J, Fang H
Coherence time in biological oscillator assemblies bounds the rate of state registration.
Todd I
Combining classical reactive scattering and the time-energy uncertainty relation.
Bonnet L, Monnerville M
Computation of Partial Auger Decay Widths from Complex-Valued Equation-of-Motion Coupled-Cluster Energies.
Matz F, Gkogkos A, Jagau TC
Computational carrier dynamics across heterojunction interface between hole injection and transport layers in quantum-dot light-emitting diodes.
Jung SM, Kim Y, Jo JW, Thelen DM, Mlejnek M, Zhang C, Kim JM
Computational dual-loop frameworks bridging single-enzyme design and cascade tunnel network engineering for next-generation biosynthetic systems.
Li Y, Du G, Chen J, Lv X, Liu L
Computational exploration of quercetin derivatives from Azadirachta indica leaf as threonine tyrosine kinase inhibitors for potential lung and pancreatic cancer treatment.
Al Imran AQM, Sarker S, Priya SN, Hossain MR, Al Ashik SA
Computational Modeling of Sequential Dependencies in Mother-Child Social Interaction and Associations to Empathic Responses.
Nunez E, Minagawa Y, Hirokawa M, Yamamoto E, Hakuno Y, Suzuki K
Computational progress of designing single-atom alloy catalysts for methane activation.
Zhou C, Zhao Q
Computational study of Actinonin@Cucurbit[8]uril supramolecular complexes for colorectal cancer therapy.
Mostefai N, Cherif FY, Ouici HB, Brahim H, Guendouzi A, Belkhiri L, Mostefa B, Guendouzi A, Alqahtani T, Sindi ER, Chakrabarty B, Zaki MEA