화학공학소재연구정보센터
검색결과 : 3건
No. Article
1 Structures of furanosides: Density functional calculations and high-resolution X-ray and neutron diffraction crystal structures
Evdokimov AG, Kalb AJ, Koetzle TF, Klooster WT, Martin JML
Journal of Physical Chemistry A, 103(6), 744, 1999
2 Correlated ab initio electronic structure calculations for large molecules
Friesner RA, Murphy RB, Beachy MD, Ringnalda MN, Pollard WT, Dunietz BD, Cao YX
Journal of Physical Chemistry A, 103(13), 1913, 1999
3 A multipole acceptability criterion for electronic structure theory
Schwegler E, Challacombe M, Head-Gordon M
Journal of Chemical Physics, 109(20), 8764, 1998