화학공학소재연구정보센터
검색결과 : 5건
No. Article
1 An Ab-Initio Study of CRC - A Comparison of Different Levels of Theory Including Density-Functional Methods
Maclagan RG, Scuseria GE
Journal of Chemical Physics, 106(4), 1491, 1997
2 Ionization Surfaces for Small Molecules
Vallance C, Maclagan RG, Harland PW
Journal of Physical Chemistry A, 101(19), 3505, 1997
3 Rearrangement of Protonated Propene Oxide to Protonated Propanal
Coxon JM, Maclagan RG, Rauk A, Thorpe AJ, Whalen D
Journal of the American Chemical Society, 119(20), 4712, 1997
4 An Ab-Initio Study of TiC - A Comparison of Different Levels of Theory Including Density-Functional Methods
Hack MD, Maclagan RG, Scuseria GE, Gordon MS
Journal of Chemical Physics, 104(17), 6628, 1996
5 Quantum-Mechanical Calculation of Maximum Electron-Impact Single Ionization Cross-Sections for the Inert-Gases and Small Molecules
Vallance C, Harland PW, Maclagan RG
Journal of Physical Chemistry, 100(37), 15021, 1996