Optimal tooltip trajectories in a hydrogen abstraction tool recharge reaction sequence for positionally controlled diamond mechanosynthesis

Journal of Computational and Theoretical Nanoscience

Volumn 7, Issue 2, 2010, Pages 325-353

  Tarasov, Denis ^a   Akberova, Natalia ^b   Izotova, Ekaterina ^b   Alisheva, Diana ^b   Astafiev, Maksim ^a   Freitas Jr , Robert A ^c  

^a Russian Academy of Sciences   (Russian Federation)

^b KAZAN FEDERAL UNIVERSITY   (Russian Federation)

^c Institute for Molecular Manufacturing   (United States)

Author keywords

Abstraction; Carbon; Diamond; DMS; Germanium; Hydrogen; Mechanosynthesis; Nanotechnology; Pathology; Positional control; Reaction sequence; Tooltip; Trajectory

Indexed keywords

ABSTRACTION; CHEMICAL TRANSFORMATIONS; CONTROLLED REACTIONS; DIAMOND SURFACES; ETHYNYL; HYDROGEN ABSTRACTION; HYDROGEN ATOMS; MECHANICAL FORCE; MECHANOSYNTHESIS; POSITIONAL CONTROL; PROBE-BASED; RADICAL SITES; RADICAL-RADICAL COUPLING; REACTION SEQUENCES; SITE-SPECIFIC; SPENT HYDROGEN; THEORETICAL STUDY; TOOL-WORKPIECE;

ABSTRACTING; DENSITY FUNCTIONAL THEORY; GERMANIUM; HYDROGEN; NANOTECHNOLOGY; OPTIMIZATION; PATHOLOGY; TOOLS; TRAJECTORIES; TWO DIMENSIONAL;

DIAMONDS;

EID: 77954900540     PISSN: 15461955     EISSN: None     Source Type: Journal    
DOI: 10.1166/jctn.2010.1365     Document Type: Review

References (29)

1. D. M. Eigler and E. K. Schweizer, Nature 344, 524 (1990).
2. N. Oyabu, O. distance, I. Yi, Y. Sugawara, and S. Morita, Phys. Rev. Lett. 90, 176102 (2003).
3. N. Oyabu, O. Custance, M. Abe, and S. Moritabe, Absts. 7th IntL Conf. on Non-Contact Atomic Force Microscopy, Seattle, Washington, USA, September (2004), p. 34.
4. Y. Sugimoto, P. Pou, O. Custance, P. Jelínek, M. Abe, R. Perez, and S. Morita, Science 322, 413 (2008).
5. K. E. Drexler, Nanosystems: Molecular Machinery, Manufacturing, and Computation, John Wiley & Sons, New York (1992).
6. R. C. Merkle, Nanotechnology 8, 149 (1997).
7. R. A. Freitas, Jr. and R. C. Merkle, J. Comput. Theor. Nanosci. 5, 760 (2008).
8. B. Temelso, C. D. Sherrill, R. C. Merkle, and R. A. Freitas, Jr., J. Phys. Chem. A 110, 11160 (2006).
9. S. M. Valone, M. Trkula, and J. R. Laia, J. Mater. Res. 5, 2296 (1990).
10. M. Page and D. W. Brenner, J. Am. Chem. Soc. 113, 3270 (1991).
11. C. B. Musgrave, J. K. Perry, R. C. Merkle, and W. A. Goddard III, Nanotechnology 2, 187 (1991).
12. X. Y. Chang, M. Perry, J. Peploski, D. L. Thompson, and L. M. Raff, J. Chem. Phys. 99, 4748 (1993).
13. S. B. Sinnott, R. J. Colton, C. T. White, and D. W. Brenner, Surf. Sci. 316, L1055 (1994).
14. D. W. Brenner, S. B. Sinnott, J. A. Harrison, and O. A. Shenderova, Nanotechnology 7, 161 (1996).
15. J. W Lyding, K. Hess, G. C. Abeln, D. S. Thompson, J. S. Moore, M. C. Hersam, E. T. Foley, J. Lee, Z. Chen, S. T. Hwang, H. Choi, P. H. Avouris, and I. C. Kizilyalli, Appl. Surf. Sci. 130, 221 (1998).
16. E. T. Foley, A. F. Kam, J. W. Lyding, and P. H. Avouris, Phys. Rev. Lett. 80, 1336 (1998).
17. M. C. Hersam, G. C. Abeln, and J. W. Lyding, Microelectron. Eng. 47, 235 (1999).
18. L. J. Lauhon and W. Ho, J. Phys. Chem. 105, 3987 (2000).
19. J. Peng, R. A. Freitas, Jr., R. C. Merkle, J. R. Von Ehr, J. N. Randall, and G. D. Skidmore, J. Comput. Theor. Nanosci. 3, 28 (2006).
20. R. C. Merkle and R. A. Freitas, Jr., J. Nanosci. Nanotechnol. 3, 319 (2003).
21. A. A. Granovsky, PC-GAMESS version 7.1 www (2009), http://classic.chem. msu.su/gran/gamessAndex.html (Some computations used version 7.0).
22. M. W. Schmidt, K. K. Baldridge, J. A. Boatz, S. T. Elbert, M. S. Gordon, J. H. Jensen, S. Koseki, N. Matsunaga, K. A. Nguyen, S. Su, T. L. Windus, M. Dupuis, and J. A. Montgomery, J. Comput. Chem. 14, 1347 (1993).
23. A. D. Becke, J. Chem. Phys. 98, 5648 (1993).
24. C. Lee, W. Yang, and R. G. Parr, Phys. Rev. B. 37, 785 (1988).
25. J. B. Foresman and A. Frisch, Exploring Chemistry with Electronic Structure Methods: A Guide to Using Gaussian, Second edn., Gaussian Inc., Pittsburgh PA (1996).
26. J. Peng, R. A. Freitas, Jr., and R. C. Merkle, J. Comput. Theor. Nanosci. 1, 62 (2004).
27. HyperCube, Inc., HyperChem Computational Chemistry, Publication HC70-00-04-00 (2002), MM2 (1991) parameter set (/runfiles/mmpstr.txt and /runfiles/mmpben.txt) contributed by Norman Allinger.
28. M. Lesbre, P. Mazerolles, and J. Stage, The Organic Compounds of Germanium, John Wiley & Sons, New York (1971).
29. C. D. Schaeffer, Jr., C. A. Strausser, M. W. Thomsen, and C. H. Yoder, Common bond energies and bond lengths, Data for General, Inorganic, Organic, and Physical Chemistry, The Wired Chemist (1989), http://www.wiredchemist.com/ chemistry/data/bond-energies-lengths.html.