Titlebook: Computational Materials, Chemistry, and Biochemistry: From Bold Initiatives to the Last Mile; In Honor of William Sadasivan Shankar,Richar

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The Role of Probability in Quantum Mechanicsfur dioxide (SO.) and elemental mercury (Hg) vapors. The screening methodology involves evaluating the performance of various chemical functionalities in polymers based on their binding energy scores of the target molecules (SO. and Hg). The QM results were validated by comparing the actual sensor r

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Computational Materials, Chemistry, and Biochemistry: From Bold Initiatives to the Last Mile978-3-030-18778-1Series ISSN 0933-033X Series E-ISSN 2196-2812

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