Recent Faculty Publications

October 2017

Single-Molecule Peptide–Lipid Affinity Assay Reveals Interplay between Solution Structure and Partitioning

Single-Molecule Peptide–Lipid Affinity Assay Reveals Interplay between Solution Structure and Partitioning

T.R. Matin, K.P. Sigdel, M. Utjesanovic, B.P. Marsh, F. Gallazzi, V.F. Smith, I. Kosztin, & G.M. King
Predicted lowest-energy structures of (a) MgPb2O3, (b) Ca/SrPb2O3, (c) BaPb2O3, (d) MgPbO2, and (e) Ca/Sr/BaPbO2 as found by first principles crystal structure search

Predicted lowest-energy structures of (a) MgPb2O3, (b) Ca/SrPb2O3, (c) BaPb2O3, (d) MgPbO2, and (e) Ca/Sr/BaPbO2 as found by first principles crystal structure search

Y. Li, L. Zhang and D.J. Singh

September 2017

Computational modelling of the thermoelectric properties of p-type Zintl compound CaMg2Bi2

Computational modelling of the thermoelectric properties of p-type Zintl compound CaMg2Bi2

Jifeng Sun, Jing Shuai, Zhifeng Ren, David J. Singh

August 2017

SERS active self-assembled diphenylalanine micro/nanostructures: A combined experimental and theoretical investigation

SERS active self-assembled diphenylalanine micro/nanostructures: A combined experimental and theoretical investigation

S. Kogikoski Jr., S. Khanra, W. A. Alves, and S. Guha
Properties of the antiferromagnetic selenite

Properties of the antiferromagnetic selenite MnSeO3 and its non-magnetic analogue ZnSnO3 from first principles calculations

C J Honer, M J Prosniewski, A Putatunda and David J Singh
Electrically induced charge-density waves in a two-dimensional electron liquid: Effects of negative electronic compressibility

Electrically induced charge-density waves in a two-dimensional electron liquid:
Effects of negative electronic compressibility

Erica E. Hroblak, Alessandro Principi, Hui Zhao, and Giovanni Vignale
Mott metal-insulator transition in the doped Hubbard-Holstein model

Mott metal-insulator transition in the doped Hubbard-Holstein model

Jamshid Moradi Kurdestany and S. Satpathy

July 2017

Effective mass of quasiparticles from thermodynamics

Effective mass of quasiparticles from thermodynamics

F. G. Eich, Markus Holzmann, G. Vignale
U(1)×SU(2) gauge invariance made simple for density functional approximations

U(1)×SU(2) gauge invariance made simple for density functional approximations

S. Pittalis, G. Vignale, and F. G. Eich

June 2017

Hybrid ZnO-organic semiconductor interfaces in photodetectors: A comparison of two near-infrared donor-acceptor copolymers

Hybrid ZnO-organic semiconductor interfaces in photodetectors: A comparison of two near-infrared donor-acceptor copolymers

A. Pickett, A. Mohapatra, A. Laudari, S. Khanra, T. Ram, S. Patil, and S. Guha
The gas-to-extinction ratio and the gas distribution in the Galaxy

The gas-to-extinction ratio and the gas distribution in the Galaxy

Hui Zhu, Wenwu Tian, Aigen Li, Mengfei Zhang

May 2017

Theory of current-induced spin polarization in an electron gas

Theory of current-induced spin polarization in an electron gas

Cosimo Gorini, Amin Maleki Sheikhabadi, Ka Shen, Ilya V. Tokatly, Giovanni Vignale, and Roberto Raimondi

April 2017

Sergei Kopeikin Book

Metric Theories of Gravity: Perturbations and Conservation Laws

Petrov, Alexander, Kopeikin, Sergei, Lompay, Robert, Tekin, Bayram

January 2017

Poisson-like height distribution of Ag nanoislands on Si(111) 7×7

Poisson-like height distribution of Ag nanoislands on Si(111) 7×7

Yiyao Chen, M. W. Gramlich, S. T. Hayden, and P. F. Miceli

December 2016

Transient particle current trough a quantum dot

Functional theories of thermoelectric phenomena

F. G. Eich, M. Di Ventra, and G Vignale