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First-Principles Assisted Prediction of the Nonlinear Optical Behavior of Mg3B7O13Cl Crystal

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In order to explore new nonlinear optical (NLO) crystals with superior performance, it is greatly desirable to understand the intrinsic relationship between the microscopic structural features and ... Click to show full abstract

In order to explore new nonlinear optical (NLO) crystals with superior performance, it is greatly desirable to understand the intrinsic relationship between the microscopic structural features and ...

Keywords: prediction nonlinear; assisted prediction; optical behavior; principles assisted; nonlinear optical; first principles

Journal Title: Journal of the Physical Society of Japan
Year Published: 2017

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