| 1 |
Dynamic Properties of a Hexadecamolybdenum Wheel: Studies in Solution and Density Functional Theory Calculations
Kachmar A, Floquet S, Lemonnier JF, Cadot E, Rohmer MM, Benard M
Inorganic Chemistry, 48(14), 6852, 2009 |
| 2 |
Conformational Changes in a Flexible, Encapsulated Dicarboxylate: Evidence from Density Functional Theory Simulations
Kachmar A, Benard M, Rohmer MM, Boero M, Massobrio C
Journal of Physical Chemistry A, 113(32), 9075, 2009 |
| 3 |
Influence of electron-attractor substituents on the magnetic properties of Ni(II) string complexes
Lopez X, Benard M, Rohmer MM
Inorganic Chemistry, 46(1), 5, 2007 |
| 4 |
DFT modeling of sandwich complexes involving cationic palladium chains and polyenic or polycyclic aromatic hydrocarbons
Labeguerie P, Benard M, Rohmer MM
Inorganic Chemistry, 46(13), 5283, 2007 |
| 5 |
Changing the oxothiomolybdate ring from an anionic to a cationic receptor
Lemonnier JF, Floquet S, Marrot J, Kachmar A, Benard M, Rohmer MM, Haouas M, Taulelle F, Henry M, Cadot E
Inorganic Chemistry, 46(23), 9516, 2007 |
| 6 |
Cu-Pd-Cu and Cu-Pt-Cu linear frameworks: Synthesis, magnetic properties, and theoretical analysis of two mixed-metal complexes of dipyridylamide (dpa), isostructural, and isoelectronic with [Cu3(dPa)(4)Cl-2](+)
Liu IPC, Lee GH, Peng SM, Benard M, Rohmer MM
Inorganic Chemistry, 46(23), 9602, 2007 |
| 7 |
A DFT based ligand field study of the EPR spectra of Co(II) and Cu(II) porphyrins
Atanasov M, Daul CA, Rohmer MM, Venkatachalam T
Chemical Physics Letters, 427(4-6), 449, 2006 |
| 8 |
Structure and magnetism of [M-3](6/7+) metal chain complexes from density functional theory: Analysis for copper and predictions for silver
Benard M, Berry JF, Cotton FA, Gaudin C, Lopez X, Murillo CA, Rohmer MM
Inorganic Chemistry, 45(10), 3932, 2006 |
| 9 |
Synthesis and characterization of octa- and hexanuclear polyoxomolybdate wheels: Role of the inorganic template and of the counterion
Dolbecq A, Lisnard L, Mialane P, Marrot J, Benard M, Rohmer MM, Secheresse F
Inorganic Chemistry, 45(15), 5898, 2006 |
| 10 |
Even-numbered metal chain complexes: Synthesis, characterization, and DFT analysis of [Ni-4(mu(4)-Tsdpda)(4)(H2O)(2)] (Tsdpda(2)-=N-(p-toluenesulfonyl)dipyridyldiamido), [Ni-4(mu(4)-Tsdpda)(4)]+, and related Ni-4 string complexes
Lopez X, Huang MY, Huang GC, Peng SM, Li FY, Benard M, Rohmer MM
Inorganic Chemistry, 45(22), 9075, 2006 |
