"Transferable Classical Force Field for Pure and Mixed Metal Halide ..."

Juan Antonio Seijas-Bellido et al. (2022)

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DOI: 10.1021/ACS.JCIM.1C01506

access: open

type: Journal Article

metadata version: 2023-09-30

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Juan Antonio Seijas-Bellido, Bipasa Samanta, Karen Valadez-Villalobos, Juan Jesús Gallardo, Javier Navas, Salvador R. G. Balestra, Rafael María Madero Castro, José Manuel Vicent-Luna, Shuxia Tao, Maytal Caspary Toroker, Juan Antonio Anta:
Transferable Classical Force Field for Pure and Mixed Metal Halide Perovskites Parameterized from First-Principles. J. Chem. Inf. Model. 62(24): 6423-6435 (2022)

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