Parallel density matrix propagation in spin dynamics simulations
β Scribed by Edwards, Luke J.; Kuprov, Ilya
- Book ID
- 118238300
- Publisher
- American Institute of Physics
- Year
- 2012
- Tongue
- English
- Weight
- 718 KB
- Volume
- 136
- Category
- Article
- ISSN
- 0021-9606
No coin nor oath required. For personal study only.
π SIMILAR VOLUMES
A computer simulation has been used to calculate the effects of J coupling on the amplitudes of echoes produced by CPMG sequences. The program computes the evolution of the density matrix for different pulse intervals and can predict the signals obtainable from spin systems of any size and complexit
Many biological processes are characterized by an essentially quantum dynamical event, such as electron or proton transfer, in a complex classical environment. To treat such processes properly by computer simulation, allowing nonadiabatic transitions involving excited states, we recently developed a