arXiv subjects

Bogdan Dabrowski

Publications and source records attributed to Bogdan Dabrowski.

5 recordsLinked to original sources

arXiv2025

Lattice Parameters and Bulk Modulus of SrTi$_{1-\mathit{x}}$Mn$_{\mathit{x}}$O$_{3}$ Perovskites: A Comparison of Exchange-Correlation Functionals with Experimental Validation

We assessed four exchange-correlation functionals (LDA CA-PZ, GGA parametrized by PBE, PBEsol, and WC) in predicting the lattice parameters of SrTi$_{1-\mathit{x}}$Mn$_{\mathit{x}}$O$_{3}$ perovskites, assuming cubic structures. Predictions were verified using X-ray diffraction (XRD) for Mn content of $\mathit{x}$ = 0.0, 0.1, 0.2, 0.3, 0.5, 1.0, confirming cubic symmetry and a linear decrease in lattice parameters with increasing Mn. PBEsol and WC demonstrated the highest precision (deviations < 0.20%). Additionally, bulk moduli were calculated using the same functionals and verified with the experimental bulk modulus of SrTiO$_{3}$ (183 $\pm$ 2 GPa, Pulse-Echo method). The predicted bulk moduli exhibited a slow, linear increase with increasing Mn. The best correspondence with the experimental bulk modulus was achieved by PBEsol and WC (deviations < 0.7%). These findings highlight the reliability of PBEsol and WC functionals for accurately modeling structural properties of SrTi$_{1-\mathit{x}}$Mn$_{\mathit{x}}$O$_{3}$ perovskites, having better precision than commonly employed LDA and PBE functionals.

cond-mat.mtrl-sci↗

arXiv2021

Increase of YBa2Cu3O7 critical currents by Mo substitution and high pressure oxygen annealing

We have previously shown for powders that Mo substitution into the CuO chains of YBa2Cu3O7 can create effective pinning centres which significantly increase the critical current density (j_c) in 7 T field by a factor of 4 and 10 at 50 and 60 K, respectively. The present work reports on the influence of the Mo substitution and high-pressure oxygen annealing on the pinning properties and critical currents of YBa_2Cu_{3-x}Mo_xO_{7-d} by comparing pure (x = 0, d > 0) and substituted (x = 0.03, d < 0) single crystals. Pinning properties have been investigated by measurements of magnetization loops and calculations of j_c in the ab-plane, in the temperature range from 2 to 90 K and in fields up to 14 T. Depending on the Mo substitution and the oxygen treatment, several types of pinning centres increasing j_c have been revealed and analysed in the frame of Dew-Hughes' and Kramer's models.

cond-mat.supr-con↗

arXiv2017

Unusual ferroelectric and magnetic phases in multiferroic 2H-BaMnO$_3$ ceramics

The structural phase transition in hexagonal BaMnO$_3$ occurring at $T_c$=130 K was studied in ceramic samples using electron and X-ray diffraction, second harmonic generation as well as by dielectric and lattice dynamic spectroscopies. The low-temperature phase (space group $P6_{3}cm$) is ferroelectric with a triplicated unit cell. The phase transition is driven by an optical soft mode from the Brillouin-zone boundary [$q = (\frac{1}{3},\frac{1}{3},0)$]; this mode activates in infrared and Raman spectra below $T_c$ and it hardens according to the Cochran law. Upon cooling below $T_c$, the permittivity exhibits an unusual linear increase with temperature; below 60 K, in turn, a frequency-dependent decrease is observed, which can be explained by slowing-down of ferroelectric domain wall motions. Based on our data we could not distinguish whether the high-temperature phase is paraelectric or polar (space groups $P6_{3}/mmc$ or $P6_{3}mc$, respectively). Both variants of the phase transition to the ferroelectric phase are discussed based on the Landau theory. Electron paramagnetic resonance and magnetic susceptibility measurements reveal an onset of one-dimensional antiferromagnetic ordering below $\approx220\,\rm K$ which develops fully near 140 K and, below $T_{n} \approx 59\,\rm K$, it transforms into a three-dimensional antiferromagnetic order.

cond-mat.mtrl-sci↗

arXiv2014

Neutron Scattering Studies of the Ferroelectric Distortion and Spin Dynamics in the Type-1 Multiferroic Perovskite Sr0.56Ba0.44MnO3

The magnetic order, spin dynamics, and crystal structure of the multiferroic Sr0.56Ba0.44MnO3 have been investigated using neutron and x-ray scattering. Ferroelectricity develops at TC=305 K with a polarization of 4.2 microC/cm2 associated with the displacements of the Mn ions, while the Mn4+ spins order below TN = 200 K into a simple G-type commensurate magnetic structure. Below TN the ferroelectric order decreases dramatically demonstrating that the two order parameters are strongly coupled. The ground state spin dynamics are characterized by a spin gap of 4.6(5) meV and the magnon density of states peaking at 43 meV. Detailed spin wave simulations with a gap and isotropic exchange of J=4.8(2) meV describe the excitation spectrum well. Above TN strong spin correlations coexist with robust ferroelectric order.

cond-mat.mtrl-sci↗

arXiv2000

Magnetic Field Induced Low-Energy Spin Excitations in YBa2Cu4O8 Measured by High Field Gd3+ ESR

We have measured the spin susceptibility of the underdoped high temperature superconductor, YBa2Cu4O8 by Gd^{3+} electron spin resonance in single crystals and aligned powders at several magnetic fields between 3 and 15.4 T. At low temperatures and high fields, the spin susceptibility of the CuO2 planes is enhanced slightly in the $B\parallel c$ orientation with respect to the $B\perp c$ orientation. The enhancement in an applied field of 15.4 T ($\approx 0.15 H_{c2}$) at 16 K (0.2 $T_c$) is approximately 10 percent of the susceptibility measured at $T_c$. Such a small magnitude suggests that the second critical field of superconductivity, $H_{c2}\approx 100 T$, would not suppress the pseudogap. This work demonstrates the potential of high field ESR in single crystals for studying high $T_c$ superconductors.

cond-mat.supr-con↗