TY - JOUR AU - Deyu, Getnet Kacha AU - Parikh, Trupen AU - Wenskat, Marc AU - Gonzalez Diaz-Palacio, Isabel AU - Blick, Robert H. AU - Zierold, Robert AU - Hillert, Wolfgang TI - Reducing the Thermal Effects during Coating of Superconducting Radio-Frequency Cavities: A Case Study for Atomic Layer Deposition of Alumina with a Combined Numerical and Experimental Approach JO - Chemistry of materials VL - 36 IS - 6 SN - 0897-4756 CY - Washington, DC PB - American Chemical Society M1 - PUBDB-2024-07526 SP - 2846-2856 PY - 2024 AB - Coating the inner surface of superconducting radio frequency (SRF) cavities is one of the strategies to push ultimate limits in next generation accelerators. One of the potential coating techniques for such intricate and large volume structures is atomic layer deposition (ALD), as it offers full and uniform layer coverage. In order to predict the process parameters for coating SRF cavities on the large substrates with ALD, we simulate the ALD of alumina (Al<sub>2</sub>O<sub>3</sub>) on the ANSYS Fluent 19.1 commercial package by solving vapor transport and chemistry equations. The computational domain in the numerical model is based on the homemade ALD setup for thin film sample chamber and a 1.3 GHz Tesla-shaped niobium cavity. Trimethlyaluminum (TMA) and water (H<sub>2</sub>O) were used as precursors. In the simulation process for the cavity, two steps were carried out: first, the simulation of precursor distribution, followed by the simulation of surface reactions. The simulations show that saturation is achieved with precursor pulses of only 50 ms after 1.05 s for TMA and 750 ms for H<sub>2</sub>O, obviating the necessity for prolonged exposure times. Furthermore, the resulting predicted growth per cycle of these process times of ≈1.22 Å for Al2O3 was experimentally validated, affirming the credibility of our simulations. Experimental findings also showcased a remarkable 66.2 LB - PUB:(DE-HGF)16 UR - <Go to ISI:>//WOS:001180297700001 DO - DOI:10.1021/acs.chemmater.3c03173 UR - https://bib-pubdb1.desy.de/record/619278 ER -