149 citations
- University of MichiganUS12 papers
- Brookhaven National LaboratoryUS2 papers
- University of PennsylvaniaUS2 papers
- Ames National LaboratoryUS1 paper
- Argonne National LaboratoryUS1 paper
- Center for Functional Nanomaterials1 paper
- City University of New YorkUS1 paper
- Collaborative Innovation Center of Chemistry for Energy MaterialsCN1 paper
- Fudan UniversityCN1 paper
- Iowa State UniversityUS1 paper
- Malmö UniversitySE1 paper
- Pennsylvania State UniversityUS1 paper
13 papers
Simulating dynamic bonding in soft materials
Tyla R. Holoman, B. P. Prajwal, Glen M. Hocky +1
Dynamic bonding is an essential feature of many soft materials. Molecular simulations have proven to be a powerful tool for modeling bonding kinetics and thermodynamics in these ma…
Quantifying Local Point-Group-Symmetry Order in Complex Particle Systems
Domagoj Fijan, Maria R. Ward Rashidi, Jenna Bradley +1
Crystals and other condensed phases are defined primarily by their inherent symmetries, which play a crucial role in dictating their structural properties. In crystallization studi…
Crystallization of Binary Nanocrystal Superlattices and the Relevance of Short-Range Attraction
Emanuele Marino, R. Allen LaCour, Timothy C. Moore +11
The synthesis of binary nanocrystal superlattices (BNSLs) enables the targeted integration of orthogonal physical properties, like photoluminescence and magnetism, into a single su…
Change Point Detection of Events in Molecular Simulations using dupin
Brandon L. Butler, Domagoj Fijan, Sharon C. Glotzer
Particle tracking is commonly used to study time-dependent behavior in many different types of physical and chemical systems involving constituents that span many length scales, in…
Quasicrystalline Nanocrystal Superlattice with Partial Matching Rules
Xingchen Ye, Jun Chen, M. Eric Irrgang +4
Expanding the library of self-assembled superstructures provides insight into the behavior of atomic crystals and supports the development of materials with mesoscale order. Here w…
Epitaxy enhancement in oxide/tungsten heterostructures by harnessing the interface adhesion
Anna L. Ravensburg, Rimantas Brucas, Denis Music +4
The conditions whereby epitaxy is achieved are commonly believed to be mostly governed by misfit strain. We report on a systematic investigation of growth and interface structure o…