화학공학소재연구정보센터
검색결과 : 2건
No. Article
1 Computational Modeling for scanning tunneling microscopy of physisorbed molecules via ab initio quantum chemistry
Crystal J, Zhang LY, Friesner RA, Flynn GW
Journal of Physical Chemistry A, 106(9), 1802, 2002
2 Calculation of the ionization potentials and electron affinities of bacteriochlorophyll and bacteriopheophytin via ab initio quantum chemistry
Crystal J, Friesner RA
Journal of Physical Chemistry A, 104(11), 2362, 2000