2021
DOI: 10.1016/j.colsurfa.2020.125932
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Experimental validation and molecular dynamics simulation of removal of PO residue on Co surface by alkaline cleaning solution with different functional groups

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Cited by 28 publications
(14 citation statements)
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“…The minimum contact angle was 51 °with EDTA reaching 0.15 wt%, which is close to that of clean Co surface. 27 It showed that the optimum effect of cleaning the Co(II)-NA complex on Co surface could be obtained under this concentration. The ions.…”
Section: Resultsmentioning
confidence: 89%
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“…The minimum contact angle was 51 °with EDTA reaching 0.15 wt%, which is close to that of clean Co surface. 27 It showed that the optimum effect of cleaning the Co(II)-NA complex on Co surface could be obtained under this concentration. The ions.…”
Section: Resultsmentioning
confidence: 89%
“…43 However, the i corr of fresh cobalt sample was 2.154 μA cm −2 . 27 The i corr was one order of magnitude lower than that of fresh Co samples, indicating that residues on Co surface had not been completely removed after cleaning. The i corr of the Co surface cleaned by different concentrations of TMAH increased significantly.…”
Section: Resultsmentioning
confidence: 90%
See 1 more Smart Citation
“…Similarly, the LUMO is associated with the innermost orbital that contains vacancies and signifies the capacity to accept electrons. 27,32,[42][43][44] Figure 9 shows the optimized molecular structural formulas of CAO, LAPAO, JFCE, OA12, DTAC, and TX100. The spatial distribution of the optimized molecular, HOMO and LUMO energy levels of the six surfactants and DIW are shown in Fig.…”
Section: Resultsmentioning
confidence: 99%
“…The summing approach is based on Ewald's electrostatic force and atoms' van der Waals forces. 21,[25][26][27][28][29] Quench simulations were performed for the whole system to obtain the lowest energy configuration, and finally the total energy of the complex system was calculated.…”
Section: Methodsmentioning
confidence: 99%