In: Physics of the Dark Universe, 2018, vol. 22, p. 162–180
The Global Network of Optical Magnetometers to search for Exotic physics (GNOME) is a network of geographically separated, time-synchronized, optically pumped atomic magnetometers that is being used to search for correlated transient signals heralding exotic physics. The GNOME is sensitive to nuclear- and electron-spin couplings to exotic fields from astrophysical sources such as compact...
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In: Physical Review B, 2018, vol. 97, no. 12, p. 125149
Recent ultrafast magnetic-sensitive measurements [Johnson et al., Phys. Rev. B 92, 184429 (2015); Bothschafter et al., Phys. Rev. B 96, 184414 (2017)] have revealed a delayed melting of the long-range cycloid spin order in TbMnO3 following photoexcitation across the fundamental Mott-Hubbard gap. The microscopic mechanism behind this slow transfer of energy from the photoexcited carriers to...
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In: Journal of Statistical Physics, 2006, vol. 125, no. 1, p. 77-124
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In: Environmental Entomology, 2010, vol. 39, no. 2, p. 715-726
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In: Reviews of Modern Physics, 2014, vol. 86, no. 2, p. 779–837
The study of nonequilibrium phenomena in correlated lattice systems has developed into one of the most active and exciting branches of condensed matter physics. This research field provides rich new insights that could not be obtained from the study of equilibrium situations, and the theoretical understanding of the physics often requires the development of new concepts and methods. On the...
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In: Inorganic Chemistry, 2011, vol. 50, no. 16, p. 7460–7477
A theoretical, computational, and conceptual framework for the interpretation and prediction of the magnetic anisotropy of transition metal complexes with orbitally degenerate or orbitally nearly degenerate ground states is explored. The treatment is based on complete active space self-consistent field (CASSCF) wave functions in conjunction with N-electron valence perturbation theory...
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In: EPPO Bulletin, 2009, vol. 39, no. 1, p. 87 - 93
PRATIQUE is an EC-funded 7th Framework research project designed to address the major challenges for pest risk analysis (PRA) in Europe. It has three principal objectives: (a) to assemble the datasets required to construct PRAs valid for the whole of the EU, (b) to conduct multi-disciplinary research that enhances the techniques used in PRA and (c) to provide a decision support scheme for PRA...
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In: Inorganic Chemistry, 2008, vol. 47, no. 7, p. 2449–2463
Magnetic anisotropy in cyanide-bridged single-molecule magnets (SMMs) with FeIII−CN−MII (M = Cu, Ni) exchange-coupled pairs was analyzed using a density functional theory (DFT)-based ligand field model. A pronounced magnetic anisotropy due to exchange was found for linear FeIII−CN−MII units with fourfold symmetry. This results from spin–orbit...
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In: The Journal of Physical Chemistry A, 2006, vol. 110, no. 49, p. 13332 -13340
Exchange coupling across the cyanide bridge in a series of novel cyanometalate complexes with CuII-NC-MIII (M = Cr and low-spin Mn,Fe) fragments has been studied using the broken-symmetry DFT approach and an empirical model, which allows us to relate the exchange coupling constant with σ-, π-, and π*-type spin densities of the CN⁻ bridging ligand. Ferromagnetic...
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In: Comptes Rendus Chimie, 2005, vol. 8(9-10), p. 1421-1433
An overview of the theory and applications of a recently proposed ligand-field density functional theory (LFDFT) is given. We describe a procedure based on DFT allowing to deduce the parameters of this non-empirical LF approach consisting of the following steps: (i) an average of configuration (AOC) DFT calculation, with equal occupancies of the d-orbitals is carried out (ii) with...
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