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Journal of Computational and Data-Driven Materials Engineering
ISSN: 3149-9368
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Vol 3, Issue 1 (2024)

Algorithmic Consensus vs Scientific Consensus in Materials Prediction
Sanjay Kulkarni, Meenal Joshi & Rohan Patil
Original Research | Open access | 18 March 2024 | Article: 108
Closed-World Training in an Open Materials Universe
Natalia Petrova, Elena Stoyanova & Ivan Dimitrov
Original Research | Open access | 18 March 2024 | Article: 109
Data Lineage and Scientific Traceability in Computational Materials Pipelines
Lucas Andrade & Mariana Lopes
Original Research | Open access | 18 March 2024 | Article: 110
Discovery Recommendation Systems: Reframing Materials Selection Algorithms
Wei Liu & Zhang Min
Original Research | Open access | 18 March 2024 | Article: 111
Experimental Validation Bottlenecks in AI-Guided Materials Design
Oliver Grant, Daniel Brooks & Amelia Carter
Original Research | Open access | 18 March 2024 | Article: 112
Knowledge Graphs vs Property Predictors: Competing Infrastructures of Materials Intelligence
Fatima Zahra Amrani & Youssef Benali
Original Research | Open access | 18 March 2024 | Article: 113
Latent Anisotropy: Directional Bias in Materials Embedding Spaces
Daniel Brooks, Ethan Moore & Amelia Carter
Original Research | Open access | 18 March 2024 | Article: 114
A Critical Examination of "State-of-the-Art" Claims in Materials GNNs: Benchmark Artifacts and Unstated Limitations
Ahmed Benali, Karim Boudiaf & Samir Touati
Original Research | Open access | 18 January 2024 | Article: 26
Toward Community-Agreed Metrics for Generative Materials Models: A Position on Inverse Design Reporting
Sven Larsson, Erik Johansson & Anna Nilsson
Original Research | Open access | 18 January 2024 | Article: 27
Benchmarking Practices for ML Interatomic Potentials: A Critical Review of Methodological Pitfalls and What Was Missed (2017–2023)
Paolo Ricci, Marco De Luca, Giulia Ferraro & Antonio Russo
Review | Open access | 18 January 2024 | Article: 28
Separating Epistemic from Aleatoric Uncertainty in Materials Graph Networks for High-Risk Predictions
Chinedu Okafor & Amina Bello
Original Research | Open access | 18 January 2024 | Article: 29
Why Active Learning Fails for Defect Formation Energies: When Uncertainty Sampling Misleads Discovery
Yousef Al-Qahtani, Fahad Al-Salem & Abdullah Al-Harbi
Original Research | Open access | 18 January 2024 | Article: 30
Boundary Conditions for Trustworthy Uncertainty Quantification in Materials AI: A Framework for Decision-Ready Confidence
Anna Kowalska, Piotr Nowak, Tomasz Zielinski & Katarzyna Mazur
Original Research | Open access | 18 January 2024 | Article: 31
How Noise Propagates in Multi-Fidelity Materials Models: From DFT Error to ML Prediction Variance
George Papadopoulos & Eleni Georgiou
Original Research | Open access | 18 January 2024 | Article: 32
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