Latest Research in Machine Learning in Materials Science

17 research papers · 2026 median publication year

Top Research Topics in Machine Learning in Materials Science

Highest-Cited Papers

  1. Regulating Charge Accumulation and Recombination in Fluorescent Blue OLEDs Using Spontaneous Orientation Polarization Active TPBi Doping of HTL
  2. Strong Hydrogen Bond Interaction Induced Dimensional Evolution in Aromatic Diammonium-Based Perovskite/Perovskitoid for Achieving High-Performance X-ray Detection
  3. Structural Origins of Forbidden Emission in Two-Dimensional Lead Halide Perovskites
  4. Machine Learning‐Guided Elucidation of Spacer‐Dependent Crystallization Pathways in Quasi‐2D Perovskites: Linear vs. Branched Spacer Cations
  5. Machine Learning‐Guided Elucidation of Spacer‐Dependent Crystallization Pathways in Quasi‐2D Perovskites: Linear vs. Branched Spacer Cations
  6. Molybdenum-Activated Halide Perovskites as Emerging Luminescent Materials: Advances and Challenges
  7. Cysteine-Based Hybrid Perovskite Exhibiting Thermally Tunable Dual-Band Photoluminescence
  8. Gradient Orbital Coupling in Mn‐Doped Asymmetric Units Amplifies Red Emission of NH 4 CdCl 3 for X‐Ray Scintillation Imaging
  9. Controlled Synthesis of Spherical Silver Powder via Bromide-Ion Capping of Silver Facets in Molten-Salt Electrodeposition for Photovoltaic Silver Paste
  10. Ion-Engineered Insulator-to-Semiconductor Transition in Natural 2D Biotite
  11. Ligand Engineering Enables Phase Selection and Improved Crystallinity in Metastable Orthorhombic AgInSe2 Nanocrystals
  12. Organic Metal Chalcogenide Films With Giant Birefringence
  13. Photon-enhanced thermionic emission for high-temperature solar energy conversion: materials, devices and emerging opportunities
  14. Kinetically Trapped High‐Density Interstitial Mn 2+ Enables Concentration‐Quenching‐Free Persistent Luminescence in CsCdCl 3 Perovskites
  15. High‐Entropy Perovskites: A Multifunctional Platform for Next‐Generation Energy and Optoelectronic Devices
  16. Can Strain or Anion Interchange Make an Unstable Structure Stable? Energetics, Lattice Dynamics and Strain-Tunable Band Gaps of Lithium Chalcohalide Antiperovskites (Li$_{3}$$BA$) and their Anion Interchange Variants (Li$_{3}$$AB$)
  17. Machine Learning‐Triggered Auto‐Discovery and Promotion of Luminescent Materials: From Predictive Modeling to Autonomous Laboratories
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L3 Region - - 2026 Sep Q3

Machine Learning in Materials Science

17 papers

Top Topics (7)

Perovskite Materials and Applications9
Machine Learning in Materials Science2
Materials Science2
Organic Light-Emitting Diodes Research1
Nanomaterials and Printing Technologies1
Quantum Dots Synthesis And Properties1
Thermal Radiation and Cooling Technologies1

Top Publications (17)

1.Regulating Charge Accumulation and Recombination in Fluorescent Blue OLEDs Using Spontaneous Orientation Polarization Active TPBi Doping of HTL2.Strong Hydrogen Bond Interaction Induced Dimensional Evolution in Aromatic Diammonium-Based Perovskite/Perovskitoid for Achieving High-Performance X-ray Detection3.Structural Origins of Forbidden Emission in Two-Dimensional Lead Halide Perovskites4.Machine Learning‐Guided Elucidation of Spacer‐Dependent Crystallization Pathways in Quasi‐2D Perovskites: Linear vs. Branched Spacer Cations5.Machine Learning‐Guided Elucidation of Spacer‐Dependent Crystallization Pathways in Quasi‐2D Perovskites: Linear vs. Branched Spacer Cations6.Molybdenum-Activated Halide Perovskites as Emerging Luminescent Materials: Advances and Challenges7.Cysteine-Based Hybrid Perovskite Exhibiting Thermally Tunable Dual-Band Photoluminescence8.Gradient Orbital Coupling in Mn‐Doped Asymmetric Units Amplifies Red Emission of NH 4 CdCl 3 for X‐Ray Scintillation Imaging9.Controlled Synthesis of Spherical Silver Powder via Bromide-Ion Capping of Silver Facets in Molten-Salt Electrodeposition for Photovoltaic Silver Paste10.Ion-Engineered Insulator-to-Semiconductor Transition in Natural 2D Biotite11.Ligand Engineering Enables Phase Selection and Improved Crystallinity in Metastable Orthorhombic AgInSe2 Nanocrystals12.Organic Metal Chalcogenide Films With Giant Birefringence13.Photon-enhanced thermionic emission for high-temperature solar energy conversion: materials, devices and emerging opportunities14.Kinetically Trapped High‐Density Interstitial Mn 2+ Enables Concentration‐Quenching‐Free Persistent Luminescence in CsCdCl 3 Perovskites15.High‐Entropy Perovskites: A Multifunctional Platform for Next‐Generation Energy and Optoelectronic Devices16.Can Strain or Anion Interchange Make an Unstable Structure Stable? Energetics, Lattice Dynamics and Strain-Tunable Band Gaps of Lithium Chalcohalide Antiperovskites (Li$_{3}$$BA$) and their Anion Interchange Variants (Li$_{3}$$AB$)17.Machine Learning‐Triggered Auto‐Discovery and Promotion of Luminescent Materials: From Predictive Modeling to Autonomous Laboratories
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