화학공학소재연구정보센터
검색결과 : 4건
No. Article
1 Assessment for the mean value total dressing method: Comparison with coupled cluster including triples methods for BF, NO+, CN+, C-2, BeO, NH3, CH2, H2O, BH, HF, SiH2, Li-2, LiNa, LiBe+, NeH+, and O-3
GarciaCuesta I, SanchezMarin J, deMeras AS, BenAmor N
Journal of Chemical Physics, 107(16), 6306, 1997
2 The Integral-Direct Coupled-Cluster Singles and Doubles Model
Koch H, Demeras AS, Helgaker T, Christiansen O
Journal of Chemical Physics, 104(11), 4157, 1996
3 Large-Scale Calculations of Excitation-Energies in Coupled-Cluster Theory - The Singlet Excited-States of Benzene
Christiansen O, Koch H, Halkier A, Jorgensen P, Helgaker T, Demeras AS
Journal of Chemical Physics, 105(16), 6921, 1996
4 Calculation of Size-Intensive Transition Moments from the Coupled Cluster Singles and Doubles Linear-Response Function
Koch H, Kobayashi R, Demeras AS, Jorgensen P
Journal of Chemical Physics, 100(6), 4393, 1994