Abstract
In this chapter, I will first introduce the basic concepts of sum frequency generation spectroscopy and the way how to calculate the sum frequency generation spectroscopy from the classical molecular dynamic simulation and ab initio molecular dynamics simulation. Later, I will briefly discuss the slab model I used in the calculation. Further details and calculation methods related to specific interface will be given later.
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Tang, F. (2019). Theoretical Methods in This Thesis. In: Structures and Dynamics of Interfacial Water. Springer Theses. Springer, Singapore. https://doi.org/10.1007/978-981-13-8965-8_2
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DOI: https://doi.org/10.1007/978-981-13-8965-8_2
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