Quantum computing for molecular biology

A Baiardi, M Christandl, M Reiher - ChemBioChem, 2023 - Wiley Online Library
Molecular biology and biochemistry interpret microscopic processes in the living world in
terms of molecular structures and their interactions, which are quantum mechanical by their …

Spin dynamics of flavoproteins

J Matysik, L Gerhards, T Theiss, L Timmermann… - International Journal of …, 2023 - mdpi.com
This short review reports the surprising phenomenon of nuclear hyperpolarization occurring
in chemical reactions, which is called CIDNP (chemically induced dynamic nuclear …

Spin selective charge recombination in chiral donor–bridge–acceptor triads

TP Fay, DT Limmer - The Journal of Chemical Physics, 2023 - pubs.aip.org
In this paper, we outline a physically motivated framework for describing spin-selective
recombination processes in chiral systems, from which we derive spin-selective reaction …

Dynamic mean-field theory for dense spin systems at infinite temperature

T Gräßer, P Bleicker, DB Hering, M Yarmohammadi… - Physical Review …, 2021 - APS
A dynamic mean-field theory for spin ensembles (spinDMFT) at infinite temperatures on
arbitrary lattices is established. The approach is introduced for an isotropic Heisenberg …

Interplay of spin mode locking and nuclei-induced frequency focusing in quantum dots

P Schering, PW Scherer, GS Uhrig - Physical Review B, 2020 - APS
We study the influence of nuclei-induced frequency focusing on the mode locking of spin
coherence in quantum dots subjected to a periodic train of optical pulses. In particular, we …

[HTML][HTML] Spin relaxation in radical pairs from the stochastic Schrödinger equation

TP Fay, LP Lindoy, DE Manolopoulos - The Journal of Chemical …, 2021 - pubs.aip.org
We show that the stochastic Schrödinger equation (SSE) provides an ideal way to simulate
the quantum mechanical spin dynamics of radical pairs. Electron spin relaxation effects …

Spin relaxation dynamics with a continuous spin environment: The dissipaton equation of motion approach

W Ying, Y Su, ZH Chen, Y Wang, P Huo - The Journal of Chemical …, 2024 - pubs.aip.org
We investigate the quantum dynamics of a spin coupling to a bath of independent spins via
the dissipaton equation of motion (DEOM) approach. The bath, characterized by a …

Simulation of nonequilibrium spin dynamics in quantum dots subjected to periodic laser pulses

P Schering, PW Scherer, GS Uhrig - High Performance Computing in …, 2021 - Springer
Large-scale simulations of the spin dynamics in quantum dots subjected to trains of periodic
laser pulses enable us to describe and understand related experiments. By comparing the …

[PDF][PDF] Nonequilibrium spin phenomena in quantum dots induced by periodic optical excitation

P Schering - 2021 - eldorado.tu-dortmund.de
The coherent control of a charge carrier spin that is localized in a semiconductor quantum
dot and the generation of long-lived states for information storage are of particular interest …

The Future of High Performance Computing in Biomimetics and Some Challenges

LP Fernandes, P Kharate, B Singh - High Performance Computing in …, 2024 - Springer
The future of high-performance computing (HPC) in biomimetics holds immense promise for
revolutionizing the way we draw inspiration from nature to advance technology and solve …