ChemInform Abstract: Carbonate-Bridged Lanthanoid Triangles: Single-Molecule Magnet Behavior, Inelastic Neutron Scattering, and ab initio Studies.

ChemInform ◽  
2016 ◽  
Vol 47 (32) ◽  
Author(s):  
Marcus J. Giansiracusa ◽  
Michele Vonci ◽  
Willem Van den Heuvel ◽  
Robert W. Gable ◽  
Boujemaa Moubaraki ◽  
...  
Keyword(s):  
Neutron Scattering ◽  
Ab Initio ◽  
Single Molecule ◽  
Inelastic Neutron Scattering ◽  
Inelastic Neutron ◽  
Single Molecule Magnet

scholarly journals Carbonate-Bridged Lanthanoid Triangles: Single-Molecule Magnet Behavior, Inelastic Neutron Scattering, and Ab Initio Studies

2016 ◽  
Vol 55 (11) ◽  
pp. 5201-5214 ◽  
Author(s):  
Marcus J. Giansiracusa ◽  
Michele Vonci ◽  
Willem Van den Heuvel ◽  
Robert W. Gable ◽  
Boujemaa Moubaraki ◽  
...  
Keyword(s):  
Neutron Scattering ◽  
Ab Initio ◽  
Single Molecule ◽  
Inelastic Neutron Scattering ◽  
Inelastic Neutron ◽  
Single Molecule Magnet

scholarly journals Ab initio calculations as a quantitative tool in the inelastic neutron scattering study of a single-molecule magnet analogue

2016 ◽  
Vol 52 (10) ◽  
pp. 2091-2094 ◽  
Author(s):  
Michele Vonci ◽  
Marcus J. Giansiracusa ◽  
Robert W. Gable ◽  
Willem Van den Heuvel ◽  
Kay Latham ◽  
...  
Keyword(s):  
Neutron Scattering ◽  
Ab Initio ◽  
Single Molecule ◽  
Inelastic Neutron Scattering ◽  
Molecular Geometry ◽  
Inelastic Neutron ◽  
Single Molecule Magnet ◽  
Scattering Spectra ◽  
Scattering Study ◽  
Neutron Scattering Study

Ab initio calculations of the electronic structure of Na9[Tb(W5O18)2] have allowed interpretation of the inelastic neutron scattering spectra, revealing the subtle relationship between molecular geometry and magnetic properties of two isostructural species.

Effect of Pressure on the Magnetic Anisotropy in the Single-Molecule Magnet Mn12-Acetate: An Inelastic Neutron Scattering Study

2005 ◽  
Vol 117 (27) ◽  
pp. 4311-4314 ◽  
Author(s):  
Andreas Sieber ◽  
Roland Bircher ◽  
Oliver Waldmann ◽  
Graham Carver ◽  
Grégory Chaboussant ◽  
...  
Keyword(s):  
Magnetic Anisotropy ◽  
Neutron Scattering ◽  
Single Molecule ◽  
Inelastic Neutron Scattering ◽  
Inelastic Neutron ◽  
Single Molecule Magnet ◽  
Effect Of Pressure ◽  
Scattering Study ◽  
Neutron Scattering Study

scholarly journals Magnetic Excitations in Polyoxotungstate-Supported Lanthanoid Single-Molecule Magnets: An Inelastic Neutron Scattering and ab Initio Study

2016 ◽  
Vol 56 (1) ◽  
pp. 378-394 ◽  
Author(s):  
Michele Vonci ◽  
Marcus J. Giansiracusa ◽  
Willem Van den Heuvel ◽  
Robert W. Gable ◽  
Boujemaa Moubaraki ◽  
...  
Keyword(s):  
Neutron Scattering ◽  
Ab Initio ◽  
Single Molecule ◽  
Inelastic Neutron Scattering ◽  
Inelastic Neutron ◽  
Ab Initio Study ◽  
Single Molecule Magnets ◽  
Magnetic Excitations

Direct Determination of the Anisotropy and Exchange Splittings in the Dimeric Single-Molecule Magnet [Mn4O3Cl4(O2CEt)3(py)3]2·8MeCN by Inelastic Neutron Scattering

2005 ◽  
Vol 44 (19) ◽  
pp. 6771-6776 ◽  
Author(s):  
Andreas Sieber ◽  
Dolos Foguet-Albiol ◽  
Oliver Waldmann ◽  
Stefan T. Ochsenbein ◽  
Roland Bircher ◽  
...  
Keyword(s):  
Neutron Scattering ◽  
Single Molecule ◽  
Inelastic Neutron Scattering ◽  
Direct Determination ◽  
Inelastic Neutron ◽  
Single Molecule Magnet

Measurement and ab initio modeling of the inelastic neutron scattering of solid N-methylformamide

1998 ◽  
Vol 108 (1) ◽  
pp. 351-358 ◽  
Author(s):  
Petr Bouř ◽  
Cheok N. Tam ◽  
Jana Sopková ◽  
Frans R. Trouw
Keyword(s):  
Neutron Scattering ◽  
Ab Initio ◽  
Inelastic Neutron Scattering ◽  
Inelastic Neutron ◽  
Ab Initio Modeling
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