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SUMMARY:Quantum dynamics in condensed phase using the non-perturbative hie
 rarchical equations of motion approach - Qiang Shi\, Institute of Chemistr
 y\, Chinese Academy of Sciences
DTSTART:20160830T110000Z
DTEND:20160830T120000Z
UID:TALK66999@talks.cam.ac.uk
CONTACT:Lisa Masters
DESCRIPTION:The non-perturbative hierarchical equations of motion (HEOM) m
 ethod has recently developed into an important tool to simulate quantum dy
 namics in condensed phase. I will present some new progresses on the HEOM 
 method in our group\, which includes: (1) New theoretical developments to 
 extract explicit system-bath correlation from the HEOM formalism\,[1] and 
 a combinations of the HEOM with stochastic methods.[2-3] (2) Applications 
 of the HEOM to charge transfer reactions in condensed phases\, especially 
 in proton transfer reaction\,[4-6] and charge carrier transport in organic
  molecular crystals.[7\,8] (3) Simulation of ultrafast two- dimensional an
 d pump-probe spectroscopy of photosynthetic light-harvesting complexes.[9\
 ,10]\n\n\nReferences:\n[1] L.-L. Zhu\, H. Liu\, W.-W. Xie\, and Q. Shi\, J
 . Chem. Phys. 137\, 194106 (2012).\n[2] L.-L Zhu\, H. Liu\, and Q. Shi\, N
 ew J. Phys. 15\, 095020 (2013).\n[3] L.-Z. Song and Q. Shi\, J. Chem. Phys
 . 143\, 194106 (2015).\n[4] L.-P. Chen and Q. Shi\, J. Chem. Phys. 130\, 1
 34505 (2009).\n[5] Q. Shi\, L.-L. Zhu\, and L.-P. Chen\, J. Chem. Phys. 13
 5\, 044505 (2011).\n[6] W.-W. Xie\, Y. Xu\, L.-L. Zhu\, and Q. Shi\, J. Ch
 em. Phys. 140\, 174105 (2014).\n[7] D. Wang\, L.-P. Chen\, R.-H. Zheng\, L
 .-J. Wang\, and Q. Shi\, J. Chem. Phys. 132\, 081101 (2010).\n[8] L.-Z. So
 ng and Q. Shi\, J. Chem. Phys. 142\,  174103 (2015).\n[9] L.-P. Chen\, R.-
 H. Zheng\, Y.-Y. Jing\, and Q. Shi\, J. Chem. Phys. 134\, 194508 (2011).\n
 [10] S.-M. Bai\, K. Song\, and Q. Shi\, J. Phys. Chem. Lett. 6\, 1954 (201
 5).\n
LOCATION:Unilever Lecture Theatre\,  Department of Chemistry
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