화학공학소재연구정보센터
검색결과 : 7건
No. Article
1 First-principles computation of second-order elastic constants and equations of state for tetragonal BaTiO3
Narejo G, Perger WF
Chemical Physics Letters, 493(4-6), 263, 2010
2 Application of an empirical dispersion potential to van der Waals binding in nitromethane, pentaerythritol, and pentaerythritol tetranitrate
Slough W, Perger WF
Chemical Physics Letters, 498(1-3), 97, 2010
3 First-principles vibrational studies of pentaerythritol crystal under hydrostatic pressure
Perger WF, Vutukuri S, Dreger ZA, Gupta YM, Flurchick K
Chemical Physics Letters, 422(4-6), 397, 2006
4 First-principles study of pentaerythritol tetranitrate single crystals under high pressure: Vibrational properties
Perger WF, Zhao JJ, Winey JM, Gupta YM
Chemical Physics Letters, 428(4-6), 394, 2006
5 Shielding-effectiveness modeling of carbon-fiber/nylon-6,6 composites
Janda NB, Keith JM, King JA, Perger WF, Oxby TJ
Journal of Applied Polymer Science, 96(1), 62, 2005
6 First-principles intermolecular binding energies in organic molecular crystals
Perger WF, Pandey R, Blanco MA, Zhao JJ
Chemical Physics Letters, 388(1-3), 175, 2004
7 Calculation of band gaps in molecular crystals using hybrid functional theory
Perger WF
Chemical Physics Letters, 368(3-4), 319, 2003