Exact, constraint-based structure prediction in simple protein models

Die Arbeit untersucht die exakte Vorhersage der Struktur von Proteinen in dreidimensionalen, abstrakten Proteinmodellen; insbesondere wird ein exakter Ansatz zur Strukturvorhersage in den HP-Modellen (Lau und Dill, ACS, 1989) des kubischen und kubisch-flächenzentrierten Gitters entwickelt und diskutiert. Im Gegensatz zu heuristischen Methoden liefert das vorgestellte exakte Verfahren beweisbar korrekte Strukturen. HP-Modelle (Hydrophob, Polar) repräsentieren die Rückgratkonformation eines Proteins durch Gitterpunkte und berücksichti\-gen ausschließlich die hydrophobe Wechselwirkung als treibende Kraft bei der Ausbildung der Proteinstruktur. Wesentlich für die erfolgreiche Umsetzung des vorgestellten Verfahrens ist die Verwendung von constraint-basierten Techniken. Im Zentrum steht die Berechnung und Anwendung hydrophober Kerne für die Strukturvorhersage

Coherent quench dynamics in the one-dimensional Fermi-Hubbard model

Recently, it has been shown that the momentum distribution of a metallic state of fermionic atoms in a lattice Fermi-Bose mixture exhibits coherent oscillations after a global quench that suppresses tunneling. The oscillation period is determined by the Fermi-Bose interaction strength. Here we show that similar dynamics occurs in the fermionic Hubbard model when we quench a noninteracting metallic state by introducing a Hubbard interaction and suppressing tunneling. The period is determined primarily by the interaction strength. Conversely, we show that one can accurately determine the Hubbard interaction strength from the oscillation period, taking into account corrections from any small residual tunneling present in the final Hamiltonian. Such residual tunneling shortens the period and damps the oscillations, the latter being visible in the Fermi-Bose experiment.Comment: 4 pages + 4 pages for supplementary material, 2 figures. Published versio

Two-Photon Pathway to Ultracold Ground State Molecules of 23^{23}Na40^{40}K

We report on high-resolution spectroscopy of ultracold fermionic \nak~Feshbach molecules, and identify a two-photon pathway to the rovibrational singlet ground state via a resonantly mixed \Bcres intermediate state. Photoassociation in a $^{23}$Na-$^{40}$K atomic mixture and one-photon spectroscopy on \nak~Feshbach molecules reveal about 20 vibrational levels of the electronically excited \ctrip state. Two of these levels are found to be strongly perturbed by nearby \Bsing states via spin-orbit coupling, resulting in additional lines of dominant singlet character in the perturbed complex {${\rm B}^1\Pi |v{=}4\rangle {\sim} {\rm c}^3\Sigma^+ | v{=}25\rangle$}, or of resonantly mixed character in {${\rm B}^1\Pi | v{=}12 \rangle {\sim}{\rm c}^3\Sigma^+ | v{=}35 \rangle$}. The dominantly singlet level is used to locate the absolute rovibrational singlet ground state ${\rm X}^1\Sigma^+ | v{=}0, J{=}0 \rangle$ via Autler-Townes spectroscopy. We demonstrate coherent two-photon coupling via dark state spectroscopy between the predominantly triplet Feshbach molecular state and the singlet ground state. Its binding energy is measured to be 5212.0447(1) \cm, a thousand-fold improvement in accuracy compared to previous determinations. In their absolute singlet ground state, \nak~molecules are chemically stable under binary collisions and possess a large electric dipole moment of $2.72$ Debye. Our work thus paves the way towards the creation of strongly dipolar Fermi gases of NaK molecules.Comment: 23 pages, 8 figure

Ultracold Dipolar Gas of Fermionic 23^{23}Na40^{40}K Molecules in their Absolute Ground State

We report on the creation of an ultracold dipolar gas of fermionic $^{23}$Na$^{40}$K molecules in their absolute rovibrational and hyperfine ground state. Starting from weakly bound Feshbach molecules, we demonstrate hyperfine resolved two-photon transfer into the singlet ${\rm X}^1\Sigma^+ |v{=}0,J{=}0\rangle$ ground state, coherently bridging a binding energy difference of 0.65 eV via stimulated rapid adiabatic passage. The spin-polarized, nearly quantum degenerate molecular gas displays a lifetime longer than 2.5 s, highlighting NaK's stability against two-body chemical reactions. A homogeneous electric field is applied to induce a dipole moment of up to 0.8 Debye. With these advances, the exploration of many-body physics with strongly dipolar Fermi gases of $^{23}$Na$^{40}$K molecules is in experimental reach.Comment: 5 pages, 5 figure

Coherent Interaction of a Single Fermion with a Small Bosonic Field

We have experimentally studied few-body impurity systems consisting of a single fermionic atom and a small bosonic field on the sites of an optical lattice. Quantum phase revival spectroscopy has allowed us to accurately measure the absolute strength of Bose-Fermi interactions as a function of the interspecies scattering length. Furthermore, we observe the modification of Bose-Bose interactions that is induced by the interacting fermion. Because of an interference between Bose-Bose and Bose-Fermi phase dynamics, we can infer the mean fermionic filling of the mixture and quantify its increase (decrease) when the lattice is loaded with attractive (repulsive) interspecies interactions.Comment: 4+ pages, 5 figures, updated to <a href="http://dx.doi.org/10.1103/PhysRevLett.106.115305">published version</a

A Purely Gravitational Origin for Einstein-Proca Theory

We construct a theory of gravity in which a propagating massive vector field arises from a quadratic curvature invariant. The Einstein-Cartan formulation and a partial suppression of torsion ensure the absence of ghost and strong-coupling problems, as we prove with nonlinear Lagrangian and Hamiltonian analysis. Augmenting General Relativity with a propagating torsion vector, our theory provides a purely gravitational origin of Einstein-Proca models and constrains their parameter space. As an outlook to phenomenology, we discuss the gravitational production of fermionic dark matter.Comment: 13 pages, 5 figures, 3 appendice