Search results for "Freedom"
showing 10 items of 458 documents
Test of molecular mode coupling theory for general rigid molecules
2000
We report recent progress on the test of mode coupling theory for molecular liquids (MMCT) for molecules of arbitrary shape. The MMCT equations in the long time limit are solved for supercooled water including all molecular degrees of freedom. In contrast to our earlier treatment of water as a linear molecule, we find that the glass-transition temperature ${T}_{c}$ is overestimated by the theory as was found in the case of simple liquids. The nonergodicity parameters are calculated from the ``full'' set of MMCT equations truncated at ${l}_{\mathrm{co}}=2.$ These results are compared (i) with the nonergodicity parameters from MMCT with ${l}_{\mathrm{co}}=2$ in the ``dipole'' approximation ${…
Dimensionality effects in restricted bosonic and fermionic systems
2000
The phenomenon of Bose-like condensation, the continuous change of the dimensionality of the particle distribution as a consequence of freezing out of one or more degrees of freedom in the low particle density limit, is investigated theoretically in the case of closed systems of massive bosons and fermions, described by general single-particle hamiltonians. This phenomenon is similar for both types of particles and, for some energy spectra, exhibits features specific to multiple-step Bose-Einstein condensation, for instance the appearance of maxima in the specific heat. In the case of fermions, as the particle density increases, another phenomenon is also observed. For certain types of sing…
A simple quantum gate with atom chips
2005
We present a simple scheme for implementing an atomic phase gate using two degrees of freedom for each atom and discuss its realization with cold rubidium atoms on atom chips. We investigate the performance of this collisional phase gate and show that gate operations with high fidelity can be realized in magnetic traps that are currently available on atom chips.
Dynamics of the rotational degrees of freedom in a supercooled liquid of diatomic molecules
1997
Using molecular dynamics computer simulations, we investigate the dynamics of the rotational degrees of freedom in a supercooled system composed of rigid, diatomic molecules. The interaction between the molecules is given by the sum of interaction-site potentials of the Lennard-Jones type. In agreement with mode-coupling theory (MCT), we find that the relaxation times of the orientational time correlation functions C_1^(s), C_2^(s) and C_1 show at low temperatures a power-law with the same critical temperature T_c, and which is also identical to the critical temperature for the translational degrees of freedom. In contrast to MCT we find, however, that for these correlators the time-tempera…
Ideal glass transitions for hard ellipsoids
2000
For hard ellipsoids of revolution we calculate the phase diagram for the idealized glass transition. Our equations cover the glass physics in the full phase space, for all packing fractions and all aspect ratios X$_0$. With increasing aspect ratio we find the idealized glass transition to become primarily be driven by orientational degrees of freedom. For needle or plate like systems the transition is strongly influenced by a precursor of a nematic instability. We obtain three types of glass transition lines. The first one ($\phi_c^{(B)}$) corresponds to the conventional glass transition for spherical particles which is driven by the cage effect. At the second one ($\phi_c^{(B')}$) which oc…
Local nuclear energy density functional at next-to-next-to-next-to-leading order
2008
We construct nuclear energy density functionals in terms of derivatives of densities up to sixth, next-to-next-to-next-to-leading order (N3LO). A phenomenological functional built in this way conforms to the ideas of the density matrix expansion and is rooted in the expansions characteristic to effective theories. It builds on the standard functionals related to the contact and Skyrme forces, which constitute the zero-order (LO) and second-order (NLO) expansions, respectively. At N3LO, the full functional with density-independent coupling constants, and with the isospin degree of freedom taken into account, contains 376 terms, while the functionals restricted by the Galilean and gauge symme…
Chaotization of internal motion of excitons in ultrathin layers by spin–orbit coupling
2018
We show that Rashba spin-orbit coupling (SOC) can generate chaotic behavior of excitons in two-dimensional semiconductor structures. To model this chaos, we study a Kepler system with spin-orbit coupling and numerically obtain a transition to chaos at a sufficiently strong coupling. The chaos emerges since the SOC reduces the number of integrals of motion as compared to the number of degrees of freedom. Dynamically, the dependence of the exciton energy on the spin orientation in the presence of SOC produces an anomalous spin-dependent velocity resulting in chaotic motion. We observe numerically the critical dependence of the dynamics on the initial conditions, where the system can return to…
Gradual freezing of orientational degrees of freedom in cubicAr1−x(N2)xmixtures
1995
The mixed crystal ${\mathrm{Ar}}_{1\mathrm{\ensuremath{-}}\mathit{x}}$(${\mathrm{N}}_{2}$${)}_{\mathit{x}}$ is studied by Monte Carlo (MC) methods for x=0.33, 0.67, and 1.0 over a wide range of temperatures. For x=1 we find first-order transition from ordered cubic to disordered cubic, while for x=0.33 and x=0.67 we find broad nonuniform distribution functions of the local quadrupole Edwards-Anderson order parameter at low temperature. The short-range order of the quadrupolar mass distribution of the ${\mathrm{N}}_{2}$ molecules in the mixed systems is different from that observed in the pure ${\mathrm{N}}_{2}$ crystal, although the fcc symmetry has been chosen for the translational degrees…
Dynamics of distorted and undistorted soliton molecules in a mode-locked fiber laser
2019
Recent developments in real-time ultrafast measurement techniques have enabled us to prove experimentally that soliton molecules execute internal motions with some aspects similar to those of a matter molecule. Such an analogy between the dynamics of soliton molecules and the dynamics of matter molecules is based on the assumption that the dissipative solitons constituting a molecule are rigid entities sharing a common profile. Whereas this assumption drastically reduces the number of degrees of freedom, it does not hold true in general and we demonstrate that it overlooks some of the essential dynamical features of the soliton molecule. We present a theoretical study based on the principle…
Phase Transitions in Classical Fluids and Fluids with Internal Quantum States in Two Dimensions: Computer Simulations and Theory
1993
1)We investigate the properties of a model fluid whose molecules have classical degrees of freedom in two dimensions and two internal quantum states. The attractive interactions are “turned on” when the internal states are hybridized, corresponding to the molecules acquiring a “dipole” moment. The phase diagram of this system in the temperature- density plane is investigated by a combination of path integral Monte Carlo and block size analysis techniques. The results are compared with mean- field—theory predictions. 2) We present molecular dynamics simulation results of quenches into the unstable region of a two-dimensional Lennard-Jones system. The evolution of the system from the non-equi…