Related papers: Ortho-Para Conversion in CH3F. Self-Consistent The…
Based on recent $Herschel$ results, the ortho-to-para ratio (OPR) of NH$_2$ has been measured towards the following high-mass star-forming regions: W31C (G10.6-0.4), W49N (G43.2-0.1), W51 (G49.5-0.4), and G34.3+0.1. The OPR at thermal…
Spin crossover molecules have recently emerged as a family of compounds potentially useful for implementing molecular spintronics devices. The calculations of the electronic properties of such molecules is a formidable theoretical challenge…
We investigate the evolution of the ortho-to-para ratio of overall (gas + ice) H$_2$ via the nuclear spin conversion on grain surfaces coated with water ice under physical conditions that are relevant to star- and planet-forming regions. We…
The structural properties of LaCoO3 were studied by means of high-resolution neutron powder diffraction in the temperature range 5<T<1000 K. Changes of the Co+3 spin states in this temperature interval are shown to affect not only the unit…
We introduce a shell-model theory that combines traditional spherical states, which yield a diagonal representation of the usual single-particle interaction, with collective configurations that track deformations, and test the validity of…
Electrons in a two-dimensional semiconducting heterostructure interact with nuclear spins via the hyperfine interaction. Using a a Kondo lattice formulation of the electron-nuclear spin interaction, we show that the nuclear spin system…
The pattern of neutrino mixing, usually parameterized by the Pontecorvo-Maki-Nakagawa-Sakata $U_{\rm PMNS}$ matrix, still remains a striking puzzle in particle physics. $U_{\rm PMNS}$ is one of six possible products of multiplying three…
Spin-polarized isospin asymmetric nuclear matter is studied within the Dirac-Brueckner-Hartree-Fock approach. After a brief review of the formalism, we present and discuss the self-consistent single-particle potentials at various levels of…
A fully ab initio scheme based on quantum chemical wavefunction methods is used to investigate the correlated multiorbital electronic structure of a 3d-metal compound, LaCoO3. The strong short-range electron correlations, involving both Co…
The properties of spin polarized pure neutron matter and symmetric nuclear matter are studied using the finite range simple effective interaction, upon its parametrization revisited. Out of the total twelve parameters involved, we now…
We present a new model for the study of spin-orbit coupling in interacting quasi-one-dimensional systems and solve it exactly to find the spectral properties of such systems. We show that the combination of spin-orbit coupling and…
The study of hyperfine interactions in optically excited fullerenes has recently acquired importance within the context of nuclear spin entanglement for quantum information technology. We here report a first-principles pseudopotential study…
The paper reports new results of the 57Fe M\"ossbauer measurements on Fe3PO4O3 powder sample recorded at various temperatures including the point of magnetic phase transition TN ~ 163K. The spectra measured above TN consist of quadrupole…
In Er$^{3+}$:Y$_2$SiO$_5$, we demonstrate the selective optical addressing of the $^{89}$Y$^{3+}$ nuclear spins through their superhyperfine coupling with the Er$^{3+}$ electronic spins possessing large Land\'e $g$-factors. We…
A new parametrization PC-PK1 for the nuclear covariant energy density functional with nonlinear point-coupling interaction is proposed by fitting to observables for 60 selected spherical nuclei, including the binding energies, charge radii…
Motivated by recent measurements which strongly support a nonzero reactor mixing angle $\theta_{13}$, we study a deviation from $S_3$ neutrino discrete symmetry by explicitly breaking the neutrino mass matrix with a general retrocirculant…
Multi-hydrogenated species with proper symmetry properties can present different spin configurations, and thus exist under different spin symmetry forms, labeled as para and ortho for two-hydrogen molecules. We investigated here the…
The spin-crossover in organometallic molecules constitutes one of the most promising routes towards the realization of molecular spintronic devices. In this article, we explore the hybridization-induced spin-crossover in metal-organic…
Following the recent successful formation and manipulation of entangled $C^{13}$ atoms on the surface of Diamond we calculate the decoherence of the electron spin polarization in Diamond via a nonperturbative treatment of the time-dependent…
The nuclear spin-dependent parity nonconserving (PNC) interaction arising from a combination of the hyperfine interaction and the coherent, spin-independent, PNC interaction from Z exchange is evaluated using many-body perturbation theory.…