On thermodynamic inconsistencies in several photosynthetic and solar cell models and how to fix them

David Gelbwaser-Klimovsky, Alán Aspuru-Guzik

Research output: Contribution to journalArticlepeer-review

Abstract

We analyze standard theoretical models of solar energy conversion developed to study solar cells and photosynthetic systems. We show that assuming the energy transfer to the reaction center/electric circuit is through a decay rate or “sink”, contradicts the second law of thermodynamics. We put forward a thermodynamically consistent alternative by explicitly considering parts of the reaction center/electric circuit and by employing a Hamiltonian transfer. The predicted energy transfer by the new scheme differs from the one found using a decay rate, casting doubts on the validity of the conclusions obtained by models which include the latter.

Original languageEnglish
Pages (from-to)1008-1014
Number of pages7
JournalChemical Science
Volume8
Issue number2
DOIs
StatePublished - 2017
Externally publishedYes

All Science Journal Classification (ASJC) codes

  • General Chemistry

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