Efficient Calculation of Charge-Transfer Matrix Elements for Hole Transfer in DNA

2008 ◽  
Vol 112 (26) ◽  
pp. 7937-7947 ◽  
Author(s):  
Tomáš Kubař ◽  
P. Benjamin Woiczikowski ◽  
Gianaurelio Cuniberti ◽  
Marcus Elstner
Keyword(s):  
Charge Transfer ◽  
Transfer Matrix ◽  
Matrix Elements ◽  
Hole Transfer ◽  
Efficient Calculation

scholarly journals Optics of Chromites and Charge-Transfer Transitions

2008 ◽  
Vol 2008 ◽  
pp. 1-4 ◽  
Author(s):  
Andrei V. Zenkov
Keyword(s):  
Charge Transfer ◽  
Simple Structure ◽  
Electric Dipole Transition ◽  
Wave Functions ◽  
Final States ◽  
Matrix Elements ◽  
Cluster Approach ◽  
Electron Wave ◽  
Charge Transfer Transitions ◽  
Transition Modeling

Specific features of the charge-transfer (CT) states and O2p→Cr3d transitions in the octahedral (CrO6)9− complex are considered in the cluster approach. The reduced matrix elements of the electric-dipole transition operator are calculated on many-electron wave functions of the complex corresponding to the initial and final states of a CT transition. Modeling the optic spectrum of chromites has yielded a complicated CT band. The model spectrum is in satisfactory agreement with experimental data which demonstrates the limited validity of the generally accepted concept of a simple structure of CT spectra.

Calculation of the excitation transfer matrix elements between the S2 or S1 state of carotenoid and the S2 or S1 state of bacteriochlorophyll

1993 ◽  
Vol 98 (10) ◽  
pp. 8012-8023 ◽  
Author(s):  
Hiroyoshi Nagae ◽  
Toshiaki Kakitani ◽  
Tetzuya Katoh ◽  
Mamoru Mimuro
Keyword(s):  
Transfer Matrix ◽  
Excitation Transfer ◽  
Matrix Elements

NiO nanowires as hole-transfer layer for drastic enhancement of CdSe-sensitized photocathodes

2019 ◽  
Vol 43 (10) ◽  
pp. 4075-4081
Author(s):  
Shuang Zhao ◽  
Yuming Dong ◽  
Guangli Wang ◽  
Pingping Jiang ◽  
Yuxia Zhang ◽  
...  
Keyword(s):  
Charge Transfer ◽  
Transfer Rate ◽  
Capture Efficiency ◽  
Transfer Layer ◽  
Hole Transfer ◽  
Charge Transfer Rate ◽  
Light Capture

Grass-like NiO nanowires as a hole-transfer layer to improve light capture efficiency and charge transfer rate for a CdSe-sensitized photocathode.

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