Properties of low-lying excited manifolds in acetate

K Park, MR Pederson, CS Hellberg - Physical Review B, 2004 - APS
Most experimental properties of the single-molecule magnet Mn 12 acetate have been
successfully explained by the assumption that Mn 12 acetate has an effective ground-state …

First-principles modeling of magnetic excitations in

VV Mazurenko, YO Kvashnin, F Jin, HA De Raedt… - Physical Review B, 2014 - APS
We have developed a fully microscopic theory of magnetic properties of the prototype
molecular magnet Mn 12. First, the intramolecular magnetic properties have been studied by …

Effect of extra electrons on the exchange and magnetic anisotropy in the anionic single-molecule magnet

K Park, MR Pederson - Physical Review B—Condensed Matter and Materials …, 2004 - APS
To understand the effect of molecular environment on the electronic and magnetic properties
of the single-molecule magnet Mn 12, we explore two possible means for adding extra …

Thermoelectric properties of large-scale Zn3 P2 nanowire assemblies

L Brockway, V Vasiraju, H Asayesh-Ardakani… - …, 2014 - iopscience.iop.org
Gram quantities of both unfunctionalized and 1, 4-benzenedithiol (BDT) functionalized zinc
phosphide (Zn 3 P 2) nanowire powders, synthesized using direct reaction of zinc and …

Electronic structure of a molecular magnet: Theory and experiment

DW Boukhvalov, M Al-Saqer, EZ Kurmaev… - Physical Review B …, 2007 - APS
We used site-selective and element-specific resonant inelastic x-ray scattering (RIXS) to
study the electronic structure and the electron interaction effects in the molecular magnet …

Tight-binding model of Mn single-molecule magnets: Electronic and magnetic structure and transport properties

F Rostamzadeh Renani, G Kirczenow - Physical Review B—Condensed Matter …, 2012 - APS
We describe and analyze a tight-binding model of single-molecule magnets (SMMs) that
captures both the spin and spatial aspects of the SMM electronic structure. The model …

Single-Molecule Magnets:  A New Approach To Investigate the Electronic Structure of Mn12 Molecules by Scanning Tunneling Spectroscopy

M Burgert, S Voss, S Herr, M Fonin… - Journal of the …, 2007 - ACS Publications
A new approach to the deposition of Mn12 single-molecule magnet monolayers on the
functionalized Au (111) surface optimized for the investigation by means of scanning …

Understanding the gap in polyoxovanadate molecule-based magnets

A Barbour, RD Luttrell, J Choi, JL Musfeldt, D Zipse… - Physical Review B …, 2006 - APS
We report a joint experimental and theoretical investigation of the transport gap, optical
properties, and electronic structure of two chemically similar, inhomogeneously mixed-valent …

Ligand-based transport resonances of single-molecule-magnet spin filters: Suppression of Coulomb blockade and determination of easy-axis orientation

F Rostamzadeh Renani, G Kirczenow - Physical Review B—Condensed Matter …, 2011 - APS
We investigate single-molecule-magnet transistors (SMMTs) with ligands that support
transport resonances. We find the lowest unoccupied molecular orbitals of Mn 12-benzoate …

Optical properties of the molecule-based magnet

J Choi, LAW Sanderson, JL Musfeldt, A Ellern… - Physical Review B, 2003 - APS
We report the reflectance and optical conductivity of solid K 6 [V 15 As 6 O 42 (H 2 O)]⋅ 8 H
2 O over a wide energy range in order to investigate the charge degrees of freedom in this …