activity
19962021
most citedDescribing the diverse geometries of gold from nanoclusters to bulk-- a first-principles based hybrid bond order potential

33 citations · 65 across the 6 of their papers we have counts for

collaborators

6 papers

quant-ph2021

Sample-efficient adaptive calibration of quantum networks using Bayesian optimization

Cristian L. Cortes, Pascal Lefebvre, Nikolai Lauk +4

Indistinguishable photons are imperative for advanced quantum communication networks. Indistinguishability is difficult to obtain because of environment-induced photon transformati…

cond-mat.mtrl-sci2019

Machine-learned impurity level prediction for semiconductors: the example of Cd-based chalcogenides

Arun Mannodi-Kanakkithodi, Michael Y. Toriyama, Fatih G. Sen +3

The ability to predict the likelihood of impurity incorporation and their electronic energy levels in semiconductors is crucial for controlling its conductivity, and thus the semic…

physics.comp-ph2018★ 2 cited

Comparing optimization strategies for force field parameterization

Fatih G. Sen, Badri Narayanan, Jeffrey Larson +7

Classical molecular dynamics (MD) simulations enable modeling of materials and examination of microscopic details that are not accessible experimentally. The predictive capability…

cond-mat.mtrl-sci2016★ 30 cited

Unraveling the Planar-Globular Transition in Gold Nanoclusters through Evolutionary Search

Alper Kinaci, Badri Narayanan, Fatih G. Sen +4

Au nanoclusters are of technological relevance for catalysis, photonics, sensors, and of fundamental scientific interest owing to planar to globular structural transformation at an…

cond-mat.mtrl-sci2015★ 33 cited

Describing the diverse geometries of gold from nanoclusters to bulk-- a first-principles based hybrid bond order potential

Badri Narayanan, Alper Kinaci, Fatih G. Sen +4

Molecular dynamics simulations using empirical force fields (EFFs) are crucial for gaining fundamental insights into atomic structure and long timescale dynamics of Au nanoclusters…

chao-dyn1996

Difficulties with the Scars Model of Quantum Localization

Michael J. Davis

Numerical calculations studying bound eigenstates in chaotic regions of phase space, including those of the stadium billiard, are summarized. These calculations demonstrate that th…