August 2013 - Allocations-admins - mailman3.cels.anl.gov

New LCRC report submitted for dynamics
by support＠lcrc.anl.gov 30 Aug '13

30 Aug '13

Full project report at https://accounts.lcrc.anl.gov/reporting/project/2013/?project=dynamics

1 0

New LCRC report submitted for UNEDF_Optimization
by support＠lcrc.anl.gov 30 Aug '13

30 Aug '13

Full project report at https://accounts.lcrc.anl.gov/reporting/project/2013/?project=UNEDF_Optimiz…

1 0

[LCRC Accounts] Yearly Allocation Request from GDI_lean_burn
by accounts＠lcrc.anl.gov 30 Aug '13

30 Aug '13

Hello, A yearly allocation for the LCRC cluster has been requested with the following updated information: Submitter/PI: Riccardo Scarcelli Project Name: GDI_lean_burn Division: ES Project title: Investigation of advanced, high-efficiency, lean-burn or dilute gasoline combustion Associated funding: DOE - Office of Vehicle Technologies Other Systems: Science: This project focuses on ultra-lean burn and EGR/dilute gasoline combustion with focus on ignition system aspects and their effects on combustion behavior. This activity directly addresses the barrier of robust lean-burn and EGR-diluted combustion technology and controls, especially relevant to the growing trend of boosting and down-sizing engines as outlined in the U.S. DRIVE Advanced Combustion and Emissions Control Tech Team (ACEC) Roadmap. Project description: Specific tasks designed to mitigate this barrier include a comprehensive understanding of intake air flow, evolution of the fuel spray, ignition, combustion and emissions formation mechanisms, and their interaction with chamber/piston geometry and fuel injection strategies over a wide operating range as well as a systematic investigation of new ignition systems. 3D-CFD simulation will provide proper insight into the experimental results and offer guidance for improvements. Following the homogeneous operation, basic stratification strategies will be proposed through CFD and evaluated experimentally. Upon completion of the baseline engine assessment the focus will be shifted towards evaluation of advanced ignition systems.Improved combustion stability as well as potential extension of lean operating limits are going to be the key criteria for the assessment of advanced ignition systems. Given the different performance variables of these advanced ignition systems (ignition energy, location of ignition, multi-pulse etc.), 3D-CFD simulation will play a key role in determining engine operating parameters to fully utilize the potential of each advanced ignition system. CFD simulations will be performed with CONVERGE Project URL: Current FY Hours Used: undetermined amount New FY Requested allocation: 480000 Q1: 140000 Q2: 120000 Q3: 120000 Q4: 100000 Justification: Thank You, The LCRC Accounts System

1 0

[LCRC Accounts] Yearly Allocation Request from Lattice-QCD
by accounts＠lcrc.anl.gov 30 Aug '13

30 Aug '13

Hello, A yearly allocation for the LCRC cluster has been requested with the following updated information: Submitter/PI: Donald Sinclair Project Name: Lattice-QCD Division: HEP Project title: Lattice simulations of Conformal and Walking Technicolor. Associated funding: DOE Other Systems: NERSC Cray XC30, "Edison" NERSC Cray XT6, "Hopper" NERSC Cluster, "Carver" Current NERSC allocation: 10,000,000 MPP hours NICS Cray XT5, "Kraken Current Kraken allocation: 9679399 SU hours Science: We are using our simulation methods developed for lattice QCD to study extensions of the standard model of High Energy Physics, in which the Higgs sector is strongly interacting, and the Higgs fields are composites. This has become all the more relevant with the discovery of a Higgs-like particle at the LHC at CERN. We are particularly interested in QCD-like theories whose pions play the role of the Higgs field in giving masses to the W and Z weak vector bosons. Such theories are called Technicolor theories. We are particularly interested in Walking Technicolor theories, whose slowly evolving couplings evade some of the technical difficulties associated with the phenomenology of Technicolor and Extended Technicolor theories. Our initial studies are of the thermodynamics of such theories, since these provide a simple way of measuring the scales of confinement and of chiral symmetry breaking. From such simulations, we can determine if confinement and chiral-symmetry breaking survive the continuum limit. In this case, our chosen theory is QCD-like. If not the theory is a conformal field theory. We choose theories which 2-loop perturbation theory suggests have an infrared fixed point and are thus conformal. If chiral symmetry breaks spontaneously before this fixed point is reached, the fixed point is avoided and the theory is ultimately QCD-like. However, the close proximity of the fixed point means that there is a region where the running coupling constant evolves very slowly, i.e. the theory walks. The first such theory which we are studying is 'scaled up' QCD with 2 colour-sextet quarks. While these studies are continuing, we will start studies of another candidate theory, an SU(2) gauge theory with 3-Majorana (or Weyl) adjoint fermions. QCD with 2 sextet quarks has just the right number of Goldstone 'pions' (3) to give masses to the W and Z. Thus it remains an open question as to whether it has a light Higgs. SU(2) gauge theory with 3 Majorana adjoint fermions has 5 Goldstone bosons, and it is possible that one of these becomes the light Higgs. Project description: We perform simulations to evaluate the functional integrals of QCD-like theories formulated on a discrete space-time lattice, to enable determination of the non-perturbative aspects these theories. These include the properties of these theories at non-zero temperature, including the scales of confinement and chiral symmetry breaking, and such zero temperature properties as spectra (including the Higgs mass), decay constants and the running of the gauge coupling constant. We are particularly interested in those theories where the coupling constant evolves very slowly, since these are candidate 'Walking Technicolor' theories. Related to these are theories with an infrared fixed point (conformal field theories). Our first goal is to differentiate between these two different types of behaviour for candidate theories. We are performing simulations of QCD-like theories which are models for Walking or Conformal Technicolor. We have been studying theories which are essentially QCD but with colour-sextet rather than colour-triplet quarks. We hope to measure the running of the QCD coupling constant. For 2 or 3 flavours, 2-loop perturbation theory predicts an infrared fixed point. For 2 flavours, it is possible that a chiral condensate forms before this fixed point is reached. If so, the fixed point is avoided, the theory is confining, and chiral symmetry breaks spontaneously. However, there is a region where the coupling constant evolves very slowly. These are the properties required for a walking technicolor theory. Simulations we have performed so far at finite temperature suggest that this theory might walk. This is an ongoing program at NERSC and NICS. We have been performing simulations of the 2-flavour theory on Fusion close to the chiral transition on 24^3*8 lattices. This supplements the work performed on Carver at NERSC on 16^3*8 lattices, by testing for finite spatial volume effects. Preliminary results suggest that these finite volume efffects are small (see our progress report). We will complete these simulations on Blues in FY2014. In FY2014 we will start simulations of another candidate Walking-Technicolor model, a gauge theory in which the 'colour' group is SU(2) [rather than SU(3)], and the 'quarks' are 3 'flavours' of Majorana (real) fermions in the adjoint representation of the 'colour' group. We will start by simulating the finite temperature behaviour of this theory on 8^3*4 and 16^3*8 lattices on Blues. This will be supplemented by simulations on 12^3*6 lattices on Carver at NERSC. Our sextet quark codes are based on our earlier triplet quark codes and use the RHMC simulation method. The Rational Hybrid Monte Carlo (RHMC) is a stochastic molecular dynamics algorithm. The functional integral of QCD is written as a partition function of a classical field theory evolving in a fictitious time. The determinant of the Dirac operator raised to a fractional power is calculated by introducing bosonic fields (pseudofermions), and sandwiching this Dirac operator raised to minus said fractional power between them. This fractional power of the Dirac operator is approximated to machine accuracy by a rational approximation. After defining this this theory on a discrete space-time lattice, the inversions required by the partial-fraction expansion of the rational approximation are performed using Krylov space methods, in particular a multi-shift extension of the conjugate gradient algorithm. A global Metropolis Monte-Carlo accept/reject step applied at the end of each trajectory removes discretization errors introduced by the numerical integration of these stochastic equations of motion. We parallelize the code by assigning a fixed number of adjacent lattice sites to each MPI task. Network bandwidth ultimately limits how small a chunk of the lattice can be assigned to each task. Our SU(2) codes will also be based on our colour-triplet SU(3) codes. In fact the fermionic part of the code involves replacing the complex 3-vector fermion fields on the lattice sites with real 3-vector fields, and the complex 3 X 3 matrix gauge fields acting on the fermions with real 3 X 3 matrix gauge fields. The simulation algorithms will be identical to those described above. A short benchmark run of the 12^3*8 sextet code on 192 cores of Blues, indicates a performance of 517 Gflops or 2.7 Gflops/core. In each case we have checked on Fusion the per core performance remains nearly constant as the number of cores is varied, so that maximum throughput is achieved at the largest number of cores allowed by the current implementation (in this case 192). We expect similar scaling behaviour on Blues. We expect the SU(2) codes to perform similarly. The 8^3*4 simulations will be run on 16 or 32 cores (1 or 2 nodes), and the 16^3*8 simulations will be performed on 128 cores (8 nodes). It should be noted that such small (in numbers of cores) jobs are not well suited to the queue structures on Hopper or Edison at NERSC or Kraken at NICS, where large jobs are preferred. In addition, these jobs require a number of cores which is a power of 2, so that on machines that have 24 or 12 cores per node, cores would be left idle. Project URL: http://www.hep.anl.gov/dks Current FY Hours Used: undetermined amount New FY Requested allocation: 915000 Q1: 240000 Q2: 225000 Q3: 225000 Q4: 225000 Justification: The measured performance of the 24^3*8 sextet code running on 192 cores of Blues is 2.7 Gflops/core. On a long production run the performance of Blues and Fusion running on the same number of cores (192) was similar. (The Blues run took 46hours 44minutes and the Fusion run took 44hours 21minutes.) Scaling tests on Fusion have shown close to linear speedups with the number of cores used, and we suspect that the same is true for Blues. Our first quarter estimates are based on the assumption that this quarter will be devoted to finishing our sextet runs with 25 1000-trajectory runs on a 24^3*8 lattice using 192 cores. We estimate that each run will take an average of 50 wallclock-hours. In the second and subsequent quarters we will switch to the new SU(2) codes. Based on past experience, we estimate that producing, debugging, testing and tuning of these codes will take approximately 1 man-week. We make our time estimates based on the assumption that we will run either 4 32-core simulations on an 8^3*4 lattice, or 1 128-core simulation on a 16^3*8 lattice, 80% of the time. Because the fermion part of the SU(2) code is a real version of the SU(3) fundamental (triplet) fermion code, and this part of the code uses most of the CPU time in production, the SU(2) code is expected to scale similarly to the SU(3) codes. It is to be hoped that information concerning the graphics coprocessor will be forthcoming, allowing us to make the best use of Blues, thus increasing our productivity. For more information concerning code performance and scaling, read previous years' requests. Thank You, The LCRC Accounts System

1 0

New LCRC report submitted for ECG_LiAir
by support＠lcrc.anl.gov 30 Aug '13

30 Aug '13

Full project report at https://accounts.lcrc.anl.gov/reporting/project/2013/?project=ECG_LiAir

1 0

New LCRC report submitted for ECG_LiAir
by support＠lcrc.anl.gov 30 Aug '13

30 Aug '13

Full project report at https://accounts.lcrc.anl.gov/reporting/project/2013/?project=ECG_LiAir

1 0

New LCRC report submitted for Raney_Nickel
by support＠lcrc.anl.gov 30 Aug '13

30 Aug '13

Full project report at https://accounts.lcrc.anl.gov/reporting/project/2013/?project=Raney_Nickel

1 0

New LCRC report submitted for Hydro-model
by support＠lcrc.anl.gov 30 Aug '13

30 Aug '13

Full project report at https://accounts.lcrc.anl.gov/reporting/project/2013/?project=Hydro-model

1 0

New LCRC report submitted for Hydro-model
by support＠lcrc.anl.gov 30 Aug '13

30 Aug '13

Full project report at https://accounts.lcrc.anl.gov/reporting/project/2013/?project=Hydro-model

1 0

New LCRC report submitted for lith_ox_md
by support＠lcrc.anl.gov 30 Aug '13

30 Aug '13

Full project report at https://accounts.lcrc.anl.gov/reporting/project/2013/?project=lith_ox_md

1 0