PMID- 34102055
OWN - NLM
STAT- PubMed-not-MEDLINE
LR  - 20210617
IS  - 1520-5215 (Electronic)
IS  - 1089-5639 (Linking)
VI  - 125
IP  - 23
DP  - 2021 Jun 17
TI  - Efficient Steady-State Solver for the Hierarchical Equations of Motion Approach: 
      Formulation and Application to Charge Transport through Nanosystems.
PG  - 5190-5200
LID - 10.1021/acs.jpca.1c02863 [doi]
AB  - An iterative approach is introduced, which allows the efficient solution of the 
      hierarchical equations of motion (HEOM) for the steady-state of open quantum 
      systems. The approach combines the method of matrix equations with an efficient 
      preconditioning technique to reduce the numerical effort of solving the HEOM. 
      Illustrative applications to simulate nonequilibrium charge transport in 
      single-molecule junctions demonstrate the performance of the method.
FAU - Kaspar, C
AU  - Kaspar C
AD  - Institute of Physics, University of Freiburg, Hermann-Herder-Strasse 3, D-79104 
      Freiburg, Germany.
FAU - Thoss, M
AU  - Thoss M
AUID- ORCID: 0000-0003-3816-349X
AD  - Institute of Physics, University of Freiburg, Hermann-Herder-Strasse 3, D-79104 
      Freiburg, Germany.
AD  - EUCOR Centre for Quantum Science and Quantum Computing, University of Freiburg, 
      Hermann-Herder-Strasse 3, D-79104 Freiburg, Germany.
LA  - eng
PT  - Journal Article
DEP - 20210608
PL  - United States
TA  - J Phys Chem A
JT  - The journal of physical chemistry. A
JID - 9890903
SB  - IM
EDAT- 2021/06/09 06:00
MHDA- 2021/06/09 06:01
CRDT- 2021/06/08 20:14
PHST- 2021/06/09 06:00 [pubmed]
PHST- 2021/06/09 06:01 [medline]
PHST- 2021/06/08 20:14 [entrez]
AID - 10.1021/acs.jpca.1c02863 [doi]
PST - ppublish
SO  - J Phys Chem A. 2021 Jun 17;125(23):5190-5200. doi: 10.1021/acs.jpca.1c02863. Epub 
      2021 Jun 8.