المؤلفون: Xiaoyu Mi, Ming Zhang, Zheng Li

مصطلحات موضوعية: Biophysics, Medicine, Cell Biology, Physiology, Biotechnology, Cancer, Inorganic Chemistry, Physical Sciences not elsewhere classified, stimulated raman scattering, spatiotemporal resolving power, electronic density matrix, state wave packet, spatial spin density, molecular dynamics involving, ray diffraction signal, ray diffraction paves, probe coherent spin, ray diffraction, state dynamics, coherent spin, spin degree, ray pulses, ultrafast x, quantum beating, also image

Relation: https://figshare.com/articles/journal_contribution/Ultrafast_X_ray_Diffraction_Probe_of_Coherent_Spin-State_Dynamics_in_Molecules/24983327

الاتاحة: https://doi.org/10.1021/acs.jpclett.3c02892.s001
https://figshare.com/articles/journal_contribution/Ultrafast_X_ray_Diffraction_Probe_of_Coherent_Spin-State_Dynamics_in_Molecules/24983327

المؤلفون: Hiroki Uratani (3727603), Hiromi Nakai (1960750)

مصطلحات موضوعية: Biophysics, Biochemistry, Biotechnology, Ecology, Infectious Diseases, Computational Biology, Physical Sciences not elsewhere classified, science behind excited, giant icosahedral fullerenes, external electric field, complexity chemical systems, structural dynamics resulting, electronic density matrix, state dynamics, time propagation, spatially delocalized, significant advantage, numerical results, multiple nodes, local parts, functional tight, electronic excitation, electronic degrees, effective hamiltonian, computational time, binding level, binding hamiltonian, based method, also assessed, accurately reproduced

Relation: https://figshare.com/articles/dataset/Scalable_Ehrenfest_Molecular_Dynamics_Exploiting_the_Locality_of_Density-Functional_Tight-Binding_Hamiltonian/17122155

الاتاحة: https://doi.org/10.1021/acs.jctc.1c00950.s001