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Dive into the research topics where Maria Chan is active.

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Featured researches published by Maria Chan.


photovoltaic specialists conference | 2015

A fundamental study of the effects of grain boundaries on performance of poly-crystalline thin film CdTe solar cells

Tadas Paulauskas; Cyrus Sun; Fatih G. Sen; Chris Buurma; Edward S. Barnard; Sivananthan Sivalingham; Maria Chan; Moon J. Kim; Robert F. Klie

Poly-crystalline CdTe-based thin film photovoltaic devices have shown a great potential and are commercially used for large-scale energy conversion applications. Despite this success conversion efficiency of CdTe has achieved very minor improvements over the last 20 years. To overcome this stagnation and further drive cost-per-watt of the modules, better atomic-scale understanding of native dislocation structures and grain boundaries is needed. In this collaborative study we systematically investigate effects of grain boundaries using ultra-high-vacuum bonded CdTe bi-crystals with pre-defined misorientation angles.


Microscopy and Microanalysis | 2015

Atomic Scale Study of Lomer-Cottrell and Hirth Lock Dislocations in CdTe

Tadas Paulauskas; Chris Buurma; Brian Stafford; Cyrus Sun; Maria Chan; Sivananthan Sivalingham; Moon J. Kim; Robert F. Klie

Many useful and also detrimental properties of solids can be traced back to the underlying structure of dislocations and their behavior. Their presence has been studied extensively studied in the context of crystal growth on lattice mismatched substrates and dislocations may significantly alter a material’s mechanical, thermal and opto-electronic properties [1]. Experimental knowledge detailing atomically resolved chemical structure of dislocation cores is highly desirable to advance fundamental understanding of these ubiquitous structures. In this study we present atomic scale analysis of two wellknown dislocations junctions in CdTe, the Lomer-Cottrell (L-C) and the Hirth lock. Despite being textbook examples of the lowest elastic energy stair-rod dislocations their atomic structure, in particularly in zinc-blende CdTe, were unknown. Stair-rod dislocations, usually identified in terms of their lack of mobility, may have important effects on the mechanical properties which raise concerns given the trend of continuous miniaturization of semiconductor devices. Furthermore, being pure-edge dislocations, L-C and Hirth locks are likely to be found in low-angle tilt grain boundaries.


Bulletin of the American Physical Society | 2018

Determining Nanoscale Structures from Pair Distribution Function and Density Functional Theory via Multi-Objective Optimization

Spencer Hills; Fatih Sen; Alper Kinaci; Maria Chan


Bulletin of the American Physical Society | 2018

Electron-Induced Non-Equilibrium Phonon Dynamics in Two-Dimensional Materials

Sridhar Sadasivam; Maria Chan; Pierre Darancet


Bulletin of the American Physical Society | 2018

Atomic-scale study of aging effects in poly-crystalline CdTe solar cell

Jinglong Guo; Fatih Sen; Luhua Wang; Seungjin Nam; Moon J. Kim; Maria Chan; Robert F. Klie


Bulletin of the American Physical Society | 2018

Inversion of electron microscopy images using atomistic simulations and machine learning

Eric Schwenker; Fatih Sen; Spencer Hills; Maria Chan


Bulletin of the American Physical Society | 2017

Combining first principles modeling, experimental inputs, and machine learning for nanocatalysts design

Fatih Sen; Spencer Hills; Alper Kinaci; Badri Narayanan; Michael J. Davis; Stephen Gray; Subramanian K. R. S. Sankaranarayanan; Maria Chan


Bulletin of the American Physical Society | 2017

Machine learnt bond order potential to investigate the low thermal conductivity of stanene nanostructures

Mathew J. Cherukara; Badri Narayanan; Alper Kinaci; Kiran Sasikumar; Stephen Gray; Maria Chan; Subramanian K. R. S. Sankaranarayanan


Bulletin of the American Physical Society | 2017

Phonon properties and slow organic-to-inorganic sub-lattice thermalization in hybrid perovskites

Maria Chan; Angela Chang; Yi Xia; Sridhar Sadasivam; Peijun Guo; Alper Kinaci; Hao-Wu Lin; Pierre Darancet; Richard D. Schaller


Bulletin of the American Physical Society | 2015

Force field development from first principles for materials design

Maria Chan; Alper Kinaci; Badri Narayanan; Fatih G. Sen; Stephen Gray; Michael Davis; Subramanian Sankaranaryanan

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Alper Kinaci

Argonne National Laboratory

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Robert F. Klie

University of Illinois at Chicago

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Fatih Sen

Massachusetts Institute of Technology

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Badri Narayanan

Argonne National Laboratory

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Moon J. Kim

University of Texas at Dallas

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Chris Buurma

University of Illinois at Chicago

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Christopher Buurma

University of Illinois at Chicago

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Cyrus Sun

University of Texas at Dallas

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Pierre Darancet

Argonne National Laboratory

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S. Sivananthan

University of Illinois at Chicago

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