Open shells in reduced-density-matrix-functional theory

Reduced-density-matrix-functional theory is applied to open-shell systems. We introduce a spin-restricted formulation by appropriately expressing approximate correlation-energy functionals in terms of spin-dependent occupation numbers and spin-independent natural orbitals. We demonstrate that the additional constraint of total-spin conservation is indispensable for the proper treatment of open-shell systems. The formalism is applied to the first-row open-shell atoms. The obtained ground-state energies are in very good agreement with the exact values as well as other state of the art quantum chemistry calculationsComment: 4 pages, 2 figures, corrected typo

Competing spin transfer and dissipation at Co/Cu(001) interfaces on femtosecond timescales

By combining interface-sensitive non-linear magneto-optical experiments with femtosecond time resolution and ab-initio time-dependent density functional theory, we show that optically excited spin dynamics at Co/Cu(001) interfaces proceeds via spin-dependent charge transfer and backtransfer between Co and Cu. This ultrafast spin transfer competes with dissipation of spin angular momentum mediated by spin-orbit coupling already on sub 100 fs timescales. We thereby identify the fundamental microscopic processes during laser-induced spin transfer at a model interface for technologically relevant ferromagnetic heterostructures.Comment: 5 pages, 4 figure

COMPLETE SOLUTION OF THE XXZ-MODEL ON FINITE RINGS. DYNAMICAL STRUCTURE FACTORS AT ZERO TEMPERATURE.

The finite size effects of the dynamical structure factors in the XXZ-model are studied in the euclidean time $(\tau)$-representation. Away from the critical momentum $p=\pi$ finite size effects turn out to be small except for the large $\tau$ limit. The large finite size effects at the critical momentum $p=\pi$ signal the emergence of infrared singularities in the spectral $(\omega)$-representation of the dynamical structure factors.Comment: PostScript file with 12 pages + 11 figures uuencoded compresse

N-glycans of human amniotic fluid transferrin stimulate progesterone production in human first trimester trophoblast cells in vitro

Aims: During pregnancy, the placenta produces a variety of steroid hormones and proteins. Several of these substances have been shown to exert immunomodulatory effects. Progesterone is thought to mediate some of these effects by regulating uterine responsiveness. The aim of this study was to clarify the effect of amniotic fluid transferrin and its N-glycans on the release of progesterone by first trimester trophoblast cells in vitro. Methods: Cytotrophoblast cells were prepared from human first trimester placentae by trypsin-DNAse dispersion of villous tissue followed by a percoll gradient centrifugation and depletion of CD45 positive cells by magnetic cell sorting. Trophoblasts were incubated with varying concentrations (50-300 mug/ml) of transferrin from human amniotic fluid and serum as well as with N-glycans obtained from amniotic fluid transferrin. Culture supernatants were assayed for progesterone by enzyme-immunometric methods. Results: The release of progesterone increased in amniotic fluid transferrin- and N-glycan-treated trophoblast cell cultures compared to untreated trophoblast cells. There was no stimulating effect of serum transferrin on the progesterone production of trophoblast cells. Conclusions: The results suggest that amnion-transferrin and especially its N-glycans modulate the endocrine function of trophoblasts in culture by up regulating progesterone secretion

Evaluating and expanding the European Union's protected-area network toward potential post-2020 coverage targets

The Convention on Biological Diversity's (CBD) strategic plan will expire in 2020, but biodiversity loss is ongoing. Scientists call for more ambitious targets in the next agreement. The nature-needs-half movement, for example, has advocated conserving half of Earth to solve the biodiversity crisis, which has been translated to protecting 50 of each ecoregion. We evaluated current protection levels of ecoregions in the territory of one of the CBD's signatories, the European Union (EU). We also explored the possible enlargement of the Natura 2000 network to implement 30 or 50 ecoregion coverage in the EU member states’ protected area (PA) network. Based on the most recent land-use data, we examined whether ecoregions have enough natural area left to reach such high coverage targets. We used a spatially explicit mixed integer programing model to estimate the least-cost expansion of the PA network based on 3 scenarios that put different emphasis on total conservation cost, ecological representation of ecosystems, or emphasize an equal share of the burden among member states. To realize 30 and 50 ecoregion coverage, the EU would need to add 6.6 and 24.2, respectively, of its terrestrial area to its PA network. For all 3 scenarios, the EU would need to designate most recommended new PAs in seminatural forests and other semi- or natural ecosystems. Because 15 ecoregions did not have enough natural area left to implement the ecoregion-coverage targets, some member states would also need to establish new PAs on productive land, allocating the largest share to arable land. Thirty percent ecoregion coverage was met by protecting remaining natural areas in all ecoregions except 3, where productive land would also need to be included. Our results support discussions of higher ecoregions protection targets for post-2020 biodiversity frameworks. © 2020 The Authors. Conservation Biology published by Wiley Periodicals, Inc. on behalf of Society for Conservation Biology

Polarization operator approach to electron-positron pair production in combined laser and Coulomb fields

The optical theorem is applied to the process of electron-positron pair creation in the superposition of a nuclear Coulomb and a strong laser field. We derive new representations for the total production rate as two-fold integrals, both for circular laser polarization and for the general case of elliptic polarization, which has not been treated before. Our approach allows us to obtain by analytical means the asymptotic behaviour of the pair creation rate for various limits of interest. In particular, we consider pair production by two-photon absorption and show that, close to the energetic threshold of this process, the rate obeys a power law in the laser frequency with different exponents for linear and circular laser polarization. With the help of the upcoming x-ray laser sources our results could be tested experimentally.Comment: 10 pages, 3 figure

Sigma Decay at Finite Temperature and Density

Sigma decay and its relation with chiral phase transition are discussed at finite temperature and density in the framework of the Nambu-Jona-Lasinio model. The decay rate for the process sigma -> 2 pions to first order in a 1/N_c expansion is calculated as a function of temperature T and baryon density n_b. In particular, only when the chiral phase transition happens around the tricritical point, the sigma decay results in a non-thermal enhancement of pions in the final state distributions in relativistic heavy ion collisions.Comment: 6 pages, 3 Postscript figures, submitted to Chin. Phys. Let