Computational materials chemistry [electronic resource] : methods and applications / edited by L.A. Curtiss and M.S. Gordon
- Published:
- Dordrecht ; Boston : Kluwer Academic Publishers, [2004]
- Copyright Date:
- ©2004
- Physical Description:
- 1 online resource (viii, 372 pages) : illustrations
- Additional Creators:
- Curtiss, L. A. (Larry A.) and Gordon, M. S. (Mark S.)
- Access Online:
- ezaccess.libraries.psu.edu
- Contents:
- Machine generated contents note: 1.Using quantum calculations of NMR properties to elucidate local and mid-range structures in amorphous oxides, nitrides and aluminosilicates / J. A. Tossell -- 2.Molecular modeling of poly(ethylylene oxide) melts and poly(ethylene oxide) based polymer electrolytes / G. D. Smith / O. Borodin -- 3.Nanostructure formation and relaxation in metal(100) homoepitaxial thin films : atomistic and continuum modeling / C. R. Stoldt / A. R. Layson / P. A. Thiel / M. C. Bartelt / J. W. Evans / K. J. Caspersen / Da-Jiang Liu -- 4.Theoretical studies of silicon surface reactions with main group adsorbates / C. H. Choi / M. S. Gordon -- 5.Quantum-chemical studies of molecular reactivity in nanoporous materials / S. A. Zygmunt / L. A. Curtiss -- 6.Theoretical methods for modeling chemical processes on semiconductor / J. A. Steckel / M. K. Jordan -- 7.Theoretical studies of growth reactions on diamond surfaces / P. Zapol / M. S. Gordon / L. A. Curtiss / H. Tamura.
- Subject(s):
- ISBN:
- 9781402021176 and 1402021178
- Note:
- AVAILABLE ONLINE TO AUTHORIZED PSU USERS.
- Bibliography Note:
- Includes bibliographical references and index.
- Reproduction Note:
- Electronic reproduction. Berlin : Springer, 2004. Mode of access: World Wide Web. Available via SpringerLink.
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