화학공학소재연구정보센터
검색결과 : 5건
No. Article
1 Are the local electrophilicity descriptors reliable indicators of global electrophilicity trends?
Roy RK, Usha V, Paulovic J, Hirao K
Journal of Physical Chemistry A, 109(20), 4601, 2005
2 The gas-phase chemiionization reaction between samarium and oxygen atoms: A theoretical study
Paulovic J, Gagliardi L, Dyke JM, Hirao K
Journal of Chemical Physics, 120(21), 9998, 2004
3 Mechanism of ferromagnetic coupling in copper(II)-gadolinium(II) complexes
Paulovic J, Cimpoesu F, Ferbinteanu M, Hirao K
Journal of the American Chemical Society, 126(10), 3321, 2004
4 Relativistic and correlated calculations on the ground and excited states of ThO
Paulovic J, Nakajima T, Hirao K, Lindh R, Malmqvist PA
Journal of Chemical Physics, 119(2), 798, 2003
5 Third-order Douglas-Kroll ab initio model potential for actinide elements
Paulovic J, Nakajima T, Hirao K, Seijo L
Journal of Chemical Physics, 117(8), 3597, 2002