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Publications

Synchronization of oscillators with long-range power law interactions

Cornell Affiliated Author(s)
Author
Debanjan Chowdhury
M.C. Cross
Abstract

We present analytical calculations and numerical simulations for the synchronization of oscillators interacting via a long-range power law interaction on a one-dimensional lattice. We have identified the critical value of the power law exponent αc across which a transition from a synchronized to an unsynchronized state takes place for a sufficiently strong but finite coupling strength in the large system limit. We find αc =3/2. Frequency entrainment and phase ordering are discussed as a function of α1.

Journal
Physical Review E - Statistical, Nonlinear, and Soft Matter Physics
Date Published
Group (Lab)
Debanjan Chowdhury Group

Phase transformation in Si from semiconducting diamond to metallic β-Sn phase in QMC and DFT under hydrostatic and anisotropic stress

Cornell Affiliated Author(s)
Author
R. Hennig
A. Wadehra
K. Driver
W. Parker
C. Umrigar
J. Wilkins
Abstract

Silicon undergoes a phase transition from the semiconducting diamond phase to the metallic β-Sn phase under pressure. We use quantum Monte Carlo calculations to predict the transformation pressure and compare the results to density-functional calculations employing the local-density approximation, the generalized-gradient approximations PBE, PW91, WC, AM05, PBEsol, and the hybrid functional HSE06 for the exchange-correlation functional.

Journal
Physical Review B - Condensed Matter and Materials Physics
Date Published
Funding Source
0530813
0703226
0908653
Group (Lab)
Cyrus Umrigar Group

Accelerating Correlated Quantum Chemistry Calculations Using Graphical Processing Units

Cornell Affiliated Author(s)
Author
M.A. Watson
R. Olivares-Amaya
R.G. Edgar
Tomas Arias
A. Aspuru-Guzik
Abstract

Graphical processing units are now being used with dramatic effect to accelerate quantum chemistry calculations. However, early work exposed challenges involving memory bottlenecks and insufficient numerical precision. This research effort addresses those issues, proposing two new tools for accelerating matrix multiplications of arbitrary size where single-precision accuracy is not enough. © 2010, IEEE. All rights reserved.

Journal
Computing in Science and Engineering
Date Published
Group (Lab)
Tomas Arias Group

Intra-unit-cell electronic nematicity of the high-T c copper-oxide pseudogap states

Author
M.J. Lawler
K. Fujita
J. Lee
A.R. Schmidt
Y. Kohsaka
C.K. Kim
H. Eisaki
S. Uchida
J.C. Davis
J.P. Sethna
Eun-Ah Kim
Abstract

In the high-transition-temperature (high-Tc) superconductors the pseudogap phase becomes predominant when the density of doped holes is reduced. Within this phase it has been unclear which electronic symmetries (if any) are broken, what the identity of any associated order parameter might be, and which microscopic electronic degrees of freedom are active. Here we report the determination of a quantitative order parameter representing intra-unit-cell nematicity: the breaking of rotational symmetry by the electronic structure within each CuO2 unit cell.

Journal
Nature
Date Published
Group (Lab)
J.C. Seamus Davis Group
James Sethna Group
Michael Lawler Group

Material limitations of carbon-nanotube inertial balances: Possibility of intrinsic yoctogram mass resolution at room temperature

Cornell Affiliated Author(s)
Author
J. Lischner
Tomas Arias
Abstract

We present a theoretical study of the intrinsic quality factor of the fundamental flexural vibration in a carbon nanotube and its dependence on temperature, radius, length, and tension. In particular, we examine three- and four-phonon decays of the fundamental flexural mode within quantized elasticity theory.

Journal
Physical Review B - Condensed Matter and Materials Physics
Date Published
Group (Lab)
Tomas Arias Group

Erratum: Cryptotomography: Reconstructing 3D Fourier intensities from randomly oriented single-shot diffraction patterns(Physical Review Letters (2010) 104 (225501))

Cornell Affiliated Author(s)
Author
N.D. Loh
M.J. Bogan
V. Elser
A. Barty
S. Boutet
S. Bajt
J. Hajdu
T. Ekeberg
F.R.N.C. Maia
J. Schulz
M.M. Seibert
B. Iwan
N. Timneanu
S. Marchesini
I. Schlichting
R.L. Shoeman
L. Lomb
M. Frank
M. Liang
H.N. Chapman
Journal
Physical Review Letters
Date Published
Group (Lab)
Veit Elser Group

Energy landscape of silicon systems and its description by force fields, tight binding schemes, density functional methods, and quantum Monte Carlo methods

Cornell Affiliated Author(s)
Author
S.A. Ghasemi
M. Amsler
R.G. Hennig
S. Roy
S. Goedecker
T.J. Lenosky
C.J. Umrigar
L. Genovese
T. Morishita
K. Nishio
Abstract

The accuracy of the fundamental properties of the energy landscape of silicon systems obtained from density functional theory with various exchange-correlation functionals, a tight binding scheme, and force fields is studied. Depending on the application, quantum Monte Carlo or density functional theory results serve as quasiexact reference values.

Journal
Physical Review B - Condensed Matter and Materials Physics
Date Published
Group (Lab)
Cyrus Umrigar Group

Fabrication of a nanomechanical mass sensor containing a nanofluidic channel

Cornell Affiliated Author(s)
Author
R.A. Barton
B. Ilic
S.S. Verbridge
B.R. Cipriany
J.M. Parpia
H.G. Craighead
Abstract

Nanomechanical resonators operating in vacuum are capable of detecting and weighing single biomolecules, but their application to the life sciences has been limited by viscous forces that impede their motion in liquid environments. A promising approach to avoid this problem, encapsulating the fluid within a mechanical resonator surrounded by vacuum, has not yet been tried with resonant sensors of mass less than ∼100 ng, despite predictions that devices with smaller effective mass will have proportionally finer mass resolution.

Journal
Nano Letters
Date Published
Group (Lab)
Jeevak Parpia Group

Cryptotomography: Reconstructing 3D fourier intensities from randomly oriented single-shot diffraction patterns

Cornell Affiliated Author(s)
Author
N.D. Loh
M.J. Bogan
V. Elser
A. Barty
S. Boutet
S. Bajt
J. Hajdu
T. Ekeberg
F.R.N.C. Maia
J. Schulz
M.M. Seibert
B. Iwan
N. Timneanu
S. Marchesini
I. Schlichting
R.L. Shoeman
L. Lomb
M. Frank
M. Liang
H.N. Chapman
Abstract

We reconstructed the 3D Fourier intensity distribution of monodisperse prolate nanoparticles using single-shot 2D coherent diffraction patterns collected at DESY's FLASH facility when a bright, coherent, ultrafast x-ray pulse intercepted individual particles of random, unmeasured orientations. This first experimental demonstration of cryptotomography extended the expansion-maximization-compression framework to accommodate unmeasured fluctuations in photon fluence and loss of data due to saturation or background scatter.

Journal
Physical Review Letters
Date Published
Group (Lab)
Veit Elser Group

Imaging the fano lattice to hidden order transition in URu 2 Si 2

Cornell Affiliated Author(s)
Author
A.R. Schmidt
M.H. Hamidian
P. Wahl
F. Meier
A.V. Balatsky
J.D. Garrett
T.J. Williams
G.M. Luke
J.C. Davis
Abstract

Within a Kondo lattice, the strong hybridization between electrons localized in real space (r-space) and those delocalized in momentum-space (k-space) generates exotic electronic states called Ä€̃ heavy fermionsÄ€™. In URu 2 Si 2 these effects begin at temperatures around 55 K but they are suddenly altered by an unidentified electronic phase transition at T o = 17.5 K. Whether this is conventional ordering of the k-space states, or a change in the hybridization of the r-space states at each U atom, is unknown.

Journal
Nature
Date Published
Group (Lab)
J.C. Seamus Davis Group