Claim Missing Document
Check
Articles

Found 2 Documents
Search
Journal : Journal of Multiscale Materials Informatics

Investigation of Corrosion Inhibition Efficiency of Pyridine-Quinoline Compounds through Machine Learning Herowati, Wise; Akrom, Muhamad; Hidayat, Novianto Nur; Sutojo, Totok
Journal of Multiscale Materials Informatics Vol. 1 No. 1 (2024): April
Publisher : Universitas Dian Nuswantoro

Show Abstract | Download Original | Original Source | Check in Google Scholar | DOI: 10.62411/jimat.v1i1.10448

Abstract

Corrosion in materials is a significant concern for the industrial and academic fields because corrosion causes enormous losses in various fields such as the economy, environment, society, industry, security, safety, and others. Currently, material damage control using organic compounds has become a popular field of study. Pyridine and quinoline stand out as corrosion inhibitors among a myriad of organic compounds because they are non-toxic, inexpensive, and effective in a variety of corrosive environments. Experimental investigations in developing various candidate potential inhibitor compounds are time and resource-intensive. In this work, we use a quantitative structure-property relationship (QSPR)-based machine learning (ML) approach to investigate support vector machine (SVR), random forest (RF), and k-nearest neighbors (KNN) algorithms as predictive models of inhibition performance. (Inhibition efficiency) corrosion of pyridine-quinoline derivative compounds as corrosion inhibitors on iron. We found that the RF model showed the best predictive ability based on the coefficient of determination (R2) and root mean squared error (RMSE) metrics. Overall, our study provides new insights regarding the ML model in predicting corrosion inhibition on iron surfaces.
Tree Tensor Network Quantum-Classical Hybrid Neural Architecture for Efficient Data Classification Hidayat, Novianto Nur; Akrom, Muhamad
Journal of Multiscale Materials Informatics Vol. 2 No. 1 (2025): April
Publisher : Universitas Dian Nuswantoro

Show Abstract | Download Original | Original Source | Check in Google Scholar | DOI: 10.62411/jimat.v2i1.12949

Abstract

We introduce the Tree Tensor Network-enhanced Quantum-Classical Neural Network (TTN-QNet), a hybrid architecture that leverages the hierarchical structure of Tree Tensor Networks for efficient parameter representation and Variational Quantum Circuits (VQC) for expressive modeling. Unlike Tensor Ring Networks, TTNs reduce parameter redundancy through a tree-based topology, enabling scalable and interpretable computation. The proposed TTN-QNet is evaluated on the Iris, MNIST, and CIFAR-10 datasets, achieving classification accuracies of 93.2%, 85.24%, and 81.67%, respectively, on binary classification tasks. TTN-QNet demonstrates rapid convergence and robustness against barren plateaus, offering a promising direction for deep quantum learning.