화학공학소재연구정보센터
검색결과 : 12건
No. Article
1 Preliminary Study of the Influence of Environment Conditions on the Successive Hydrogenations of CO
Pirim C, Krim L, Laffon C, Parent P, Pauzat F, Pilme J, Ellinger Y
Journal of Physical Chemistry A, 114(9), 3320, 2010
2 Physisorption of molecular hydrogen on polycyclic aromatic hydrocarbons: A theoretical study
Tran F, Weber J, Wesolowski TA, Cheikh F, Ellinger Y, Pauzat F
Journal of Physical Chemistry B, 106(34), 8689, 2002
3 Density functional theory with an approximate kinetic energy functional applied to study structure and stability of weak van der Waals complexes
Wesolowski TA, Ellinger Y, Weber J
Journal of Chemical Physics, 108(15), 6078, 1998
4 A chemical application of the algebraic concept of internal space
Granucci G, Cassam-Chenai P, Ellinger Y
Journal of Chemical Physics, 108(6), 2538, 1998
5 Reduction of monophosphaallenes: An EPR study and ab initio investigations of (HPCCH2)(-center dot) and (HPCHCH2)(center dot) radicals
Chentit M, Sidorenkova H, Geoffroy M, Ellinger Y
Journal of Physical Chemistry A, 102(51), 10469, 1998
6 Interstellar Silicon-Nitrogen Chemistry .4. Which Reaction Paths to Hsin and Hnsi - An Extensive Ab-Initio Investigation with Crucial Consequences for Molecular Astrophysics
Parisel O, Hanus M, Ellinger Y
Journal of Physical Chemistry A, 101(3), 299, 1997
7 Comparative study of benzene center dot center dot center dot X (X = O-2, N-2, CO) complexes using density functional theory: The importance of an accurate exchange-correlation energy density at high reduced density gradients
Wesolowski TA, Parisel O, Ellinger Y, Weber J
Journal of Physical Chemistry A, 101(42), 7818, 1997
8 Interstellar Silicon-Nitrogen Chemistry .3. The Spectral Signatures of the H2Sin+ Molecular Ion
Parisel O, Hanus M, Ellinger Y
Journal of Chemical Physics, 104(5), 1979, 1996
9 Interstellar Silicon-Nitrogen Chemistry .2. Spectral Signatures of the Sinh2+ Molecular Ion
Parisel O, Hanus M, Ellinger Y
Journal of Physical Chemistry, 100(8), 2926, 1996
10 The Shape of the Ground and Lowest 2 Excited-States of H2No
Ricca A, Weber J, Hanus M, Ellinger Y
Journal of Chemical Physics, 103(1), 274, 1995