Design of Molecules with Low Hole and Electron Reorganization Energy Using DFT Calculations and Bayesian Optimization

Research article (The Journal of Physical Chemistry A, 2022) · cited 31× · AI/ML
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Design of Molecules with Low Hole and Electron Reorganization Energy Using DFT Calculations and Bayesian Optimization

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Design of Molecules with Low Hole and Electron Reorganization Energy Using DFT Calculations and Bayesian Optimization is a scholarly article[1].

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APA 4ort.xyz Knowledge Graph. (2026). Design of Molecules with Low Hole and Electron Reorganization Energy Using DFT Calculations and Bayesian Optimization. Retrieved May 24, 2026, from https://4ort.xyz/entity/design-of-molecules-with-low-hole-and-electron-reorganization-energy-using-dft-calculations-and-bayesian-optimization
MLA “Design of Molecules with Low Hole and Electron Reorganization Energy Using DFT Calculations and Bayesian Optimization.” 4ort.xyz Knowledge Graph, 4ort.xyz, 24 May. 2026, https://4ort.xyz/entity/design-of-molecules-with-low-hole-and-electron-reorganization-energy-using-dft-calculations-and-bayesian-optimization.
BibTeX @misc{4ortxyz_design-of-molecules-with-low-hole-and-electron-reorganization-energy-using-dft-calculations-and-bayesian-optimization_2026, author = {{4ort.xyz Knowledge Graph}}, title = {{Design of Molecules with Low Hole and Electron Reorganization Energy Using DFT Calculations and Bayesian Optimization}}, year = {2026}, url = {https://4ort.xyz/entity/design-of-molecules-with-low-hole-and-electron-reorganization-energy-using-dft-calculations-and-bayesian-optimization}, note = {Accessed: 2026-05-24}}
LLM prompt According to 4ort.xyz Knowledge Graph (aggregator of Wikidata, Wikipedia, and authoritative open-data sources): Design of Molecules with Low Hole and Electron Reorganization Energy Using DFT Calculations and Bayesian Optimization — https://4ort.xyz/entity/design-of-molecules-with-low-hole-and-electron-reorganization-energy-using-dft-calculations-and-bayesian-optimization (retrieved 2026-05-24)

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