Computational characterization of bulk heterojunction nanomorphology

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2012-01-01
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Tirthapura, Srikanta
Chaudhary, Sumit
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Mechanical Engineering
The Department of Mechanical Engineering at Iowa State University is where innovation thrives and the impossible is made possible. This is where your passion for problem-solving and hands-on learning can make a real difference in our world. Whether you’re helping improve the environment, creating safer automobiles, or advancing medical technologies, and athletic performance, the Department of Mechanical Engineering gives you the tools and talent to blaze your own trail to an amazing career.
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Electrical and Computer Engineering

The Department of Electrical and Computer Engineering (ECpE) contains two focuses. The focus on Electrical Engineering teaches students in the fields of control systems, electromagnetics and non-destructive evaluation, microelectronics, electric power & energy systems, and the like. The Computer Engineering focus teaches in the fields of software systems, embedded systems, networking, information security, computer architecture, etc.

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The Department of Electrical Engineering was formed in 1909 from the division of the Department of Physics and Electrical Engineering. In 1985 its name changed to Department of Electrical Engineering and Computer Engineering. In 1995 it became the Department of Electrical and Computer Engineering.

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1909-present

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  • Department of Electrical Engineering (1909-1985)
  • Department of Electrical Engineering and Computer Engineering (1985-1995)

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Materials Science and Engineering
Materials engineers create new materials and improve existing materials. Everything is limited by the materials that are used to produce it. Materials engineers understand the relationship between the properties of a material and its internal structure — from the macro level down to the atomic level. The better the materials, the better the end result — it’s as simple as that.
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Abstract

The bulk heterojunction (BHJ) nanomorphology in organic solar cells strongly affects the final efficiency of the device. Progress in experimental techniques now allows visualization of the complex 3D BHJ morphology. It is, therefore, important to characterize the topological properties of the morphology in order to quantify the link between morphology features and performance. Here, we introduce a suite of morphology descriptors which encode the complex nature of the multi-stage photovoltaic process in the BHJ. These morphology descriptors are easily determined using an approach based on converting the morphology into an equivalent weighted, labeled, undirected graph. We show how these descriptors can be used to interrogate BHJ morphologies, allow identification of bottlenecks in the photovoltaic process, and conduct quantitative comparison between morphologies with respect to each sub-process in the photovoltaic phenomena. This framework provides a simple and easy-to-use characterization tool that can be used to unravel the impact of morphology on complex transport phenomena.

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This article is published as Wodo, Olga, Srikanta Tirthapura, Sumit Chaudhary, and Baskar Ganapathysubramanian. "Computational characterization of bulk heterojunction nanomorphology." Journal of Applied Physics 112, no. 6 (2012): 064316. 10.1063/1.4752864. Posted with permission.

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Sun Jan 01 00:00:00 UTC 2012
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