TY - DATA T1 - Data underlying the publication: Packing of inhibitor molecules during area-selective atomic layer deposition studied using random sequential adsorption simulations PY - 2023/08/07 AU - Jun Li AU - Ilker Tezsevin AU - Marc J. M. Merkx AU - Joost F. W. Maas AU - Wilhelmus M. M. Kessels AU - Tania E. Sandoval AU - Adrie Mackus UR - DO - 10.4121/33df3424-ed9b-49cb-910e-64a6d37aa6b0.v1 KW - Random sequential adsorption KW - Area selective deposition KW - atomic layer deposition KW - inhibitor packing N2 -

This dataset includes raw and processed data published in manuscript "Packing of inhibitor molecules during area-selective atomic layer deposition studied using random sequential adsorption simulations". Area-selective atomic layer deposition (ALD) can be achieved by functionalization of the area where no growth is desired with inhibitor molecules. The packing of these inhibitor molecules, in terms of molecule arrangement and surface density, plays a vital role in deactivating the surface by blocking the precursor adsorption. Here, we performed random sequential adsorption (RSA) simulations to investigate the packing of small molecule inhibitors (SMIs) on a surface to predict how effective the SMI blocks precursor adsorption. We demonstrated that RSA simulations provide an insightful and straightforward method for screening SMIs in terms of their potential for area-selective ALD. This Dataset includes all the simulation and experimental data used in the manuscript. In the 'Processed data" folder, the reader can find the Matlab code to run RSA simulations, original figure files and data files. The "Raw data" folder includes all Matlab input and outputs without any editing.

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