화학공학소재연구정보센터
검색결과 : 6건
No. Article
1 Elastic constants and electronic structure of alkaline-earth chalcogenides. Performances of various hamiltonians
Marinelli F, Lichanot A
Chemical Physics Letters, 367(3-4), 430, 2003
2 Structural, electronic, and vibrational properties of solid Sr(OH)(2), calculated with different Hamiltonians
Merawa M, Civalleri B, Ugliengo P, Noel Y, Lichanot A
Journal of Chemical Physics, 119(2), 1045, 2003
3 Electronic, magnetic structures and neutron diffraction in B-1 and B-3 phases of MnS: a density functional approach
Tappero R, Wolfers P, Lichanot A
Chemical Physics Letters, 335(5-6), 449, 2001
4 Structural and vibrational properties of solid Mg(OH)(2) and Ca(OH)(2) - performances of various hamiltonians
Baranek P, Lichanot A, Orlando R, Dovesi R
Chemical Physics Letters, 340(3-4), 362, 2001
5 V-OH center in magnesium oxide: an ab initio supercell study
Lichanot A, Orlando R, Mallia G, Merawa M, Dovesi R
Chemical Physics Letters, 318(1-3), 240, 2000
6 Ab initio self-consistent calculations of the polarizability and related functions of cubic SiC
Ayma D, Lichanot A, Rerat M
Journal of Physical Chemistry B, 103(26), 5441, 1999