Quantum Simulation
12,708 papers
Quantum Simulation Research Context
This category collects papers on quantum simulation methods for chemistry, materials, many-body systems, condensed matter, and physics models.
Showing 12601-12612 of 12,708
Studying reactive processes with classical dynamics: rebinding dynamics in MbNO.
Nutt DR, Meuwly M
The cytotoxicity of ortho alkyl substituted 4-X-phenols: a QSAR based on theoretical bond lengths and electron densities.
Loader RJ, Singh N, O'malley PJ, Popelier PL
The Fe-CO bond energy in myoglobin: a QM/MM study of the effect of tertiary structure.
Strickland N, Mulholland AJ, Harvey JN
The hydration structure of 18-crown-6/K+ complex as studied by Monte Carlo simulation using ab initio fitted potential.
Krongsuk S, Kerdcharoen T, Hannongbua S
Triple-quantum correlation NMR experiments in solids using J-couplings.
Fayon F, Roiland C, Emsley L, Massiot D
Quantum systems with effective and time-dependent masses: form-preserving transformations and reality conditions
Schulze-Halberg Axel
Comparison of visual grading analysis and determination of detective quantum efficiency for evaluating system performance in digital chest radiography.
Sund P, Båth M, Kheddache S, Månsson LG
On quantum iterated function systems
Jadczyk Arkadiusz
Photoreduction of oxoisoaporphines. Another example of a formal hydride-transfer mechanism.
De la Fuente JR, Jullian C, Saitz C, Sobarzo-Sánchez E, Neira V, González C, López R, Pessoa-Mahana H
Simulating large nuclear quantum mechanical corrections in hydrogen atom transfer reactions in metalloenzymes.
Olsson MH, Siegbahn PE, Warshel A
Avoided antiferromagnetic order and quantum critical point in CeCoIn5.
Bianchi A, Movshovich R, Vekhter I, Pagliuso PG, Sarrao JL
Biindanylidenes: role of central bond torsion in nonvertical triplet excitation transfer to the stilbenes.
Saltiel J, Mace JE, Watkins LP, Gormin DA, Clark RJ, Dmitrenko O