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Publications

Benchmark problems for phase retrieval

Cornell Affiliated Author(s)
Author
V. Elser
T.-Y. Lan
T. Bendory
Abstract

In recent years, the mathematical and algorithmic aspects of the phase retrieval problem have received considerable attention. Many papers in this area mention crystallography as a principal application. In crystallography, the signal to be recovered is periodic and comprised of atomic distributions arranged homogeneously in the unit cell of the crystal. The crystallographic problem is both the leading application and one of the hardest forms of phase retrieval. We have constructed a graded set of benchmark problems for evaluating algorithms that perform this type of phase retrieval.

Journal
SIAM Journal on Imaging Sciences
Date Published
Funding Source
DE-SC0005827
Group (Lab)
Veit Elser Group

Direct visualization of sulfur cathodes: New insights into Li-S batteries via operando X-ray based methods

Cornell Affiliated Author(s)
Author
S.-H. Yu
X. Huang
K. Schwarz
R. Huang
Tomas Arias
J.D. Brock
H.D. Abruña
Abstract

As the need for the development of "beyond lithium" ion battery technologies continues unabated, lithium sulfur batteries have attracted widespread attention due to their very high theoretical energy density of 2600 W h kg-1. However, despite much effort, the detailed reaction mechanism remains poorly understood. In this study, we have combined operando X-ray diffraction and X-ray microscopy along with X-ray tomography, to visualize the evolution of both the morphology and crystal structure of the materials during the entire battery cycling (discharging/charging) process.

Journal
Energy and Environmental Science
Date Published
Funding Source
DMR-1332208
2015R1A6A3A03020354
Group (Lab)
Tomas Arias Group

MBE growth of few-layer 2H-MoTe2 on 3D substrates

Cornell Affiliated Author(s)
Author
S. Vishwanath
A. Sundar
X. Liu
A. Azcatl
E. Lochocki
A.R. Woll
S. Rouvimov
W.S. Hwang
N. Lu
X. Peng
H.-H. Lien
J. Weisenberger
S. McDonnell
M.J. Kim
M. Dobrowolska
J.K. Furdyna
K. Shen
R.M. Wallace
D. Jena
H.G. Xing
Abstract

MoTe2 is the least explored material in the Molybdenum-chalcogen family. Molecular beam epitaxy (MBE) provides a unique opportunity to tackle the small electronegativity difference between Mo and Te while growing layer by layer away from thermodynamic equilibrium. We find that for a few-layer MoTe2 grown at a moderate rate of ∼6 min per monolayer, a narrow window in temperature (above Te cell temperature) and Te:Mo ratio exists, where we can obtain pure phase 2H-MoTe2.

Journal
Journal of Crystal Growth
Date Published
Funding Source
DMR-1120296
DMR 1433490
DMR 1400432
DMR-1332208
Group (Lab)
Kyle Shen Group

Mfd Dynamically Regulates Transcription via a Release and Catch-Up Mechanism

Cornell Affiliated Author(s)
Author
T.T. Le
Y. Yang
C. Tan
M.M. Suhanovsky
Fulbright Jr., R.M.
J.T. Inman
M. Li
J. Lee
S. Perelman
J.W. Roberts
A.M. Deaconescu
M.D. Wang
Abstract

The bacterial Mfd ATPase is increasingly recognized as a general transcription factor that participates in the resolution of transcription conflicts with other processes/roadblocks. This function stems from Mfd's ability to preferentially act on stalled RNA polymerases (RNAPs). However, the mechanism underlying this preference and the subsequent coordination between Mfd and RNAP have remained elusive. Here, using a novel real-time translocase assay, we unexpectedly discovered that Mfd translocates autonomously on DNA.

Journal
Cell
Date Published
Research Area
Group (Lab)
Michelle Wang Group

Modeling Mammalian Gastrulation With Embryonic Stem Cells

Cornell Affiliated Author(s)
Author
E.D. Siggia
A. Warmflash
Abstract

Understanding cell fate patterning and morphogenesis in the mammalian embryo remains a formidable challenge. Recently, in vivo models based on embryonic stem cells (ESCs) have emerged as complementary methods to quantitatively dissect the physical and molecular processes that shape the embryo. Here we review recent developments in using ESCs to create both two- and three-dimensional culture models that shed light on mammalian gastrulation. © 2018 Elsevier Inc.

Journal
Human Embryonic Stem Cells in Development
Date Published
Funding Source
PHY 1502151
MCB-1553228
511079
R01GM126122
Research Area

Nanophotonic trapping: precise manipulation and measurement of biomolecular arrays

Cornell Affiliated Author(s)
Author
J.E. Baker
R.P. Badman
M.D. Wang
Abstract

Optical trapping is a powerful and widely used laboratory technique in the biological and materials sciences that enables rapid manipulation and measurement at the nanometer scale. However, expanding the analytical throughput of this technique beyond the serial capabilities of established single-trap microscope-based optical tweezers remains a current goal in the field.

Journal
Wiley Interdisciplinary Reviews: Nanomedicine and Nanobiotechnology
Date Published
Research Area
Group (Lab)
Michelle Wang Group

Single-molecule angular optical trapping for studying transcription under torsion

Cornell Affiliated Author(s)
Author
J. Ma
C. Tan
M.D. Wang
Abstract

Optical tweezers are flexible and powerful single-molecule tools that have been extensively utilized in biophysical studies. With their ability to stretch and twist DNA, and measure its force and torque simultaneously, they provide excellent opportunities to gain novel insights into the function of protein motors and protein-DNA interactions. Recently, a novel DNA supercoiling assay using an angular optical tweezers (AOT) has been developed to investigate torque generation during transcription. Here, we provide a detailed and practical guide to performing this technique.

Journal
Methods in Molecular Biology
Date Published
Research Area
Group (Lab)
Michelle Wang Group

The complexity of bit retrieval

Cornell Affiliated Author(s)
Author
V. Elser
Abstract

Bit retrieval is the problem of reconstructing a periodic binary sequence from its periodic autocorrelation, with applications in cryptography and x-ray crystallography. After defining the problem, with and without noise, we describe and compare various algorithms for solving it. A geometrical constraint satisfaction algorithm, relaxed-reflect-reflect, is currently the best algorithm for noisy bit retrieval. © 2017 IEEE.

Journal
IEEE Transactions on Information Theory
Date Published
Funding Source
DE-SC0005827
Group (Lab)
Veit Elser Group

Time-Dependent Linear-Response Variational Monte Carlo

Cornell Affiliated Author(s)
Author
Bastien Mussard
Emanuele Coccia
Roland Assaraf
Matthew Otten
Cyrus Umrigar
Julien Toulouse
Abstract

We present the extension of variational Monte Carlo (VMC) to the calculation of electronic excitation energies and oscillator strengths using time-dependent linear-response theory. By exploiting the analogy existing between the linear method for wave function optimization and the generalized eigenvalue equation of linear-response theory, we formulate the equations of linear-response VMC (LR-VMC). This LR-VMC approach involves the first- and second-order derivatives of the wave function with respect to the parameters.

Journal
Advances in Quantum Chemistry
Date Published
Funding Source
1534965
Group (Lab)
Cyrus Umrigar Group