FDNS21: Predictive Models in Materials Making, 2D, 3D, 2.1D

By Boris I Yakobson

Mechanical Engineering, Rice University, Houston, TX

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Bio

Boris Yakobson Dr. Yakobson is the Karl F. Hasselmann Chair in Engineering at Rice University. Dr. Yakobson holds a joint appointment between the Department of Materials Science and NanoEngineering and the Department of Chemistry. In 2008, Yakobson received a Nano 50 Award from the science magazine, Nanotech Briefs, for his innovation in nanotechnology, and in 2009, the Department of Energy R&D Award. He received his Ph.D. in 1982 from the Russian Academy of Sciences. Dr. Yakobson is an editorial board member of the Journal of Nanoparticle Research and a member of the American Physical Society and the Electrochemical Society.

Sponsored by

Network for Computational Nanotechnology Nanomanufacturing Node

Cite this work

Researchers should cite this work as follows:

  • Boris I Yakobson (2021), "FDNS21: Predictive Models in Materials Making, 2D, 3D, 2.1D," https://nanohub.org/resources/35000.

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Tags

  1. density functional theory (DFT)
  2. graphene
  3. nanomanufacturing
  4. nanoMFG Node
  5. nanowires
  6. spintronics
  7. synthesis
Predictive Models in Materials Making, 2D, 3D, 2.1D
  • Predictive Models in Materials Making: 2D, 3D, 2.1D 1. Predictive Models in Materials… 0
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  • Rice Campus 2. Rice Campus 50.717384050717385
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  • What we do 3. What we do 88.488488488488485
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  • about the title…2.1D 4. about the title…2.1D 179.87987987987989
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  • Nano-reactor 5. Nano-reactor "ancestry" in the… 251.95195195195197
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  • Nano-Reactor 6. Nano-Reactor 353.95395395395394
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  • kinetic Wulff construction 7. kinetic Wulff construction 611.61161161161158
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  • Evolutionary selection growth of 2D materials 8. Evolutionary selection growth … 687.620954287621
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  • The problem and solution/realization 9. The problem and solution/reali… 763.22989656322989
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  • H-etched hexagons alignment mapping 10. H-etched hexagons alignment ma… 822.88955622288961
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  • Grown with the wind 11. Grown with the wind 853.75375375375381
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  • Graphene-diamond chemically induced transition 12. Graphene-diamond chemically in… 874.74140807474146
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  • Beyound thermodynamics 13. Beyound thermodynamics 948.54854854854864
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  • Binding energy, per H atom 14. Binding energy, per H atom 1012.4124124124124
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  • ΔG and the nucleation barriers 15. ΔG and the nucleation barrier… 1039.1057724391057
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  • TMD: skipping complex chemistry? 16. TMD: skipping complex chemistr… 1106.74007340674
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  • General results 17. General results 1157.8244911578245
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  • Videos 18. Videos 1181.9152485819152
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  • A library of atomically thin metal chalcogenides 19. A library of atomically thin m… 1239.1391391391392
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  • AIMD charge density highlights bond formation and breaking 20. AIMD charge density highlights… 1283.7504170837506
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  • Reaction Path 21. Reaction Path 1315.3486820153487
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  • H-BN: the challenge of no-inversion-symmetry 22. H-BN: the challenge of no-inve… 1417.4174174174175
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  • Steps are entropic-rough, not straight lines! 23. Steps are entropic-rough, not … 1471.9719719719719
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  • Can the growth spillover down (or up) the steps? 24. Can the growth spillover down … 1516.1494828161494
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  • Geometrical Complementarity of Kinks 25. Geometrical Complementarity of… 1520.7540874207541
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  • From interlayer excitons to the excitonic ground state? 26. From interlayer excitons to th… 1539.2392392392394
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  • Utilizing the diversity of 2D materials 27. Utilizing the diversity of 2D … 1596.2295628962297
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  • Band structures and phonon spectra 28. Band structures and phonon spe… 1600.7340674007341
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  • Model Hamiltonian 29. Model Hamiltonian 1614.8148148148148
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  • Topological State of Hetero-bilayer with Ferroelectric Switching 30. Topological State of Hetero-bi… 1638.8388388388389
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  • For spintronics 31. For spintronics 1712.5792459125794
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  • Band structures 32. Band structures 1752.6860193526861
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  • Seems plenty of room within 2-dimensions for hybrids 33. Seems plenty of room within 2-… 1756.8902235568903
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  • Nested hybrid nanotubes 34. Nested hybrid nanotubes 1758.1247914581249
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  • Topological State of Hetero-bilayer with Ferroelectric Switching 35. Topological State of Hetero-bi… 1832.2989656322991
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  • Model Hamiltonian 36. Model Hamiltonian 1858.4584584584586
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