Provable properties of asymptotic safety in f(R) approximation

We study an f(R) approximation to asymptotic safety, using a family of non-adaptive cutoffs, kept general to test for universality. Matching solutions on the four-dimensional sphere and hyperboloid, we prove properties of any such global fixed point solution and its eigenoperators. For this family of cutoffs, the scaling dimension at large n of the nth eigenoperator, is λn ∝ b n ln n. The coefficient b is non-universal, a consequence of the single-metric approximation. The large R limit is universal on the hyperboloid, but not on the sphere where cutoff dependence results from certain zero modes. For right-sign conformal mode cutoff, the fixed points form at most a discrete set. The eigenoperator spectrum is quantised. They are square integrable under the Sturm-Liouville weight. For wrong sign cutoff, the fixed points form a continuum, and so do the eigenoperators unless we impose square-integrability. If we do this, we get a discrete tower of operators, infinitely many of which are relevant. These are f(R) analogues of novel operators in the conformal sector which were used recently to furnish an alternative quantisation of gravity.

Gradient flow and holography from a local Wilsonian cutoff

We consider the vacuum partition function of a 4d scalar QFT in a curved background as function of bare marginal and relevant couplings. A local UV cutoff $$\Lambda (x)$$ Λ ( x ) transforming under Weyl rescalings allows to construct Weyl invariant kinetic terms including Wilsonian cutoff functions. The local cutoff can be absorbed completely by a rescaling of the metric and the bare couplings. The vacuum partition function satisfies consistency conditions which follow from the Abelian nature of local redefinitions of the cutoff, and which differ from Weyl rescalings. These imply a gradient flow for beta functions describing the cutoff dependence of rescaled bare couplings. The consistency conditions allow to satisfy all but one Hamiltonian constraints required for a holographic description of the flow of bare couplings with the cutoff.

CHARMM36 Lipid Force Field with Explicit Treatment of Long-Range Dispersion: Parametrization and Validation for PE, PG, and Ether Lipids

Long-range Lennard-Jones (LJ) interactions have been incorporated into the CHARMM36 (C36) lipid force field (FF) using the LJ particle-mesh Ewald (LJ-PME) method in order to remove the inconsistency of bilayer and monolayer properties arising from the exclusion of long-range dispersion [citation to paper I]. The new FF is denoted C36/LJ-PME. While the first optimization was based on three phosphatidylcholines (PCs), this paper extends the validation and parametrization to more lipids including PC, phosphatidylethanolamine (PE), phosphatidylglycerol (PG) and ether lipids. The agreement with experimental structure data is excellent for PC, PE and ether lipids. C36/LJ-PME also compares favorably with scattering data of PG bilayers but less so with NMR deuterium order parameters of 1,2-dimyristoyl-sn-glycero-3-phospho-(1'-rac-glycerol) (DMPG) at 303.15 K, indicating a need for future optimization regarding PG-specific parameters. Frequency dependence of NMR T1 spin-lattice relaxation times is well described by C36/LJ-PME and the overall agreement with experiment is comparable to C36. Lipid diffusion is slower than C36 due to the added long-range dispersion causing a higher viscosity, although it is still too fast compared to experiment after correction for periodic boundary conditions. When using a 10 Å real-space cutoff, the simulation speed of C36/LJ-PME is roughly equal to C36. While more lipids will be incorporated into the FF in the future, C36/LJ-PME can be readily used for common lipids and extends the capability of the CHARMM FF by supporting monolayers and eliminating the cutoff dependence.<br>

CHARMM36 Lipid Force Field with Explicit Treatment of Long-Range Dispersion: Parametrization and Validation for PE, PG, and Ether Lipids

Long-range Lennard-Jones (LJ) interactions have been incorporated into the CHARMM36 (C36) lipid force field (FF) using the LJ particle-mesh Ewald (LJ-PME) method in order to remove the inconsistency of bilayer and monolayer properties arising from the exclusion of long-range dispersion [citation to paper I]. The new FF is denoted C36/LJ-PME. While the first optimization was based on three phosphatidylcholines (PCs), this paper extends the validation and parametrization to more lipids including PC, phosphatidylethanolamine (PE), phosphatidylglycerol (PG) and ether lipids. The agreement with experimental structure data is excellent for PC, PE and ether lipids. C36/LJ-PME also compares favorably with scattering data of PG bilayers but less so with NMR deuterium order parameters of 1,2-dimyristoyl-sn-glycero-3-phospho-(1'-rac-glycerol) (DMPG) at 303.15 K, indicating a need for future optimization regarding PG-specific parameters. Frequency dependence of NMR T1 spin-lattice relaxation times is well described by C36/LJ-PME and the overall agreement with experiment is comparable to C36. Lipid diffusion is slower than C36 due to the added long-range dispersion causing a higher viscosity, although it is still too fast compared to experiment after correction for periodic boundary conditions. When using a 10 Å real-space cutoff, the simulation speed of C36/LJ-PME is roughly equal to C36. While more lipids will be incorporated into the FF in the future, C36/LJ-PME can be readily used for common lipids and extends the capability of the CHARMM FF by supporting monolayers and eliminating the cutoff dependence.<br>

Probing phase transitions of holographic entanglement entropy with fixed area states

Recent results suggest that new corrections to holographic entanglement entropy should arise near phase transitions of the associated Ryu-Takayanagi (RT) surface. We study such corrections by decomposing the bulk state into fixed-area states and conjecturing that a certain ‘diagonal approximation’ will hold. In terms of the bulk Newton constant G, this yields a correction of order O(G−1/2) near such transitions, which is in particular larger than generic corrections from the entanglement of bulk quantum fields. However, the correction becomes exponentially suppressed away from the transition. The net effect is to make the entanglement a smooth function of all parameters, turning the RT ‘phase transition’ into a crossover already at this level of analysis.We illustrate this effect with explicit calculations (again assuming our diagonal approximation) for boundary regions given by a pair of disconnected intervals on the boundary of the AdS3 vacuum and for a single interval on the boundary of the BTZ black hole. In a natural large-volume limit where our diagonal approximation clearly holds, this second example verifies that our results agree with general predictions made by Murthy and Srednicki in the context of chaotic many-body systems. As a further check on our conjectured diagonal approximation, we show that it also reproduces the O(G−1/2) correction found Penington et al. for an analogous quantum RT transition. Our explicit computations also illustrate the cutoff-dependence of fluctuations in RT-areas.

Cutoff dependence of the thrust peak position in the dipole shower

We analyse the dependence of the peak position of the thrust distribution on the cutoff value in the Nagy–Soper dipole shower. We compare the outcome of the parton shower simulations to a relation of the dependence from an analytic computation, derived within soft-collinear effective theory. We show that the result of the parton shower simulations and the analytic computation are in good agreement.

Four-body bound state calculations using three-dimensional low-momentum effective interaction Vlow-k

In this paper, we solve the coupled Yakubovsky integral equations for four-body (4B) bound state using the low-momentum effective two-body interaction [Formula: see text] in a three-dimensional (3D) approach, without using a partial wave (PW) decomposition. The renormalization group (RG) evolved interaction is constructed from spin-independent Malfliet–Tjon potential using the Lee–Suzuki method. The cutoff dependence of the 4B binding energy and wave function is investigated for a wide range of the momentum cutoff [Formula: see text] of [Formula: see text] interaction from 1.0 to 8.0[Formula: see text][Formula: see text].