검색결과 : 4건
| No. | Article |
|---|---|
| 1 |
The calculation of ESR parameters by density functional theory: the g-and A-tensors of Co(acacen) Atanasov M, Baerends EJ, Baettig P, Bruyndonckx R, Daul C, Rauzy C, Zbiri M Chemical Physics Letters, 399(4-6), 433, 2004 |
| 2 |
A density functional approach to the Jahn-Teller effect of [Cu(en)(3)](2+) as a model for a macrobicyclic cage complex of copper(II) Kundu TK, Bruyndonckx R, Daul C, Manoharan PT Inorganic Chemistry, 38(17), 3931, 1999 |
| 3 |
Experimental and theoretical studies of the site exchanges in Rh-4(CO)(12) and IrRh3(CO)(12) Besancon K, Laurenczy G, Lumini T, Roulet R, Bruyndonckx R, Daul C Inorganic Chemistry, 37(21), 5634, 1998 |
| 4 |
A nonempirical approach to ground-state Jahn-Teller distortion: Case study of VCl4+ Bruyndonckx R, Daul C, Manoharan PT, Deiss E Inorganic Chemistry, 36(19), 4251, 1997 |