Predicting the Morphologies of ?’ Precipitates in Cobalt-Based Superalloys
Nov 17, 2017
Jokisaari, Naghavi, Wolverton, Voorhees and Heinonen recently published their research in Acta Materialia, 141, 273 (2017). https://doi.org/10.1016/j.actamat.2017.09.003
Charge Transport in Nanostructured Materials: Implementation and Verification of Constrained Density Functional Theory
Nov 17, 2017
Goldey, Brawand, Vörös and Galli recently published their research in J. Chem. Theory Comput. 13 (6), pp 2581-2590 (2017).
Ultrafast Exciton Dissociation and Long-Lived Charge Separation in a Photovoltaic Pentacene-MoS2 Van Der Waals Heterojunction
Nov 17, 2017
Homan, Sangwan, Balla, Bergeron, Weiss, and Hersam published their research in Nano Letters 17, 164 (2017). DOI: 10.1021/acs.nanolett.6b03704
Small Molecule Acceptor and Polymer Donor Crystallinity and Aggregation Effects on Microstructure Templating: Understanding Photovoltaic Response in Fullerene-Free Solar Cells
Nov 17, 2017
Eastham, Dudnik, Aldrich, Manley, Fauvell, Hartnett, Wasielewski, Chen, Melkonyan, Facchetti, Chang and Marks recently published their research in Chem. Mater. 2017, 29 (10), 4432-4444. DOI:10.1021/acs.chemmater.7b00964.
Coarse-Grained Model of the Dynamics of Electrolyte Solutions
Nov 17, 2017
Andrew, Chremos, de Pablo and Douglas recently published their research in Journal of Physical Chemistry B, 121, 8195-8202 (2017). DOI: 10.1021/acs.jpcb.7b04297
Including Crystal Structure Attributes in Machine Learning Models of Formation Energies Via Voronoi Tessellations
Nov 17, 2017
Ward, Liu, Krishna, Hegde, Agrawal, Choudhary, and Wolverton recently published their research in Phys. Rev. B, 96, 024104 (2017). DOI: 10.1103/PhysRevB.96.024104
Diffusion Coefficients of Transition Metals in FCC Cobalt
Nov 17, 2017
Naghavi, Hegde and Wolverton published their research in Acta Materialia. Volume 132, 15 June 2017, Pages 467–478. DOI:10.1016/j.actamat.2017.04.060
Optimizing the Mechanical Properties of Cellulose Nanopaper Through Surface Energy and Critical Length Scale Considerations
Nov 17, 2017
Qin, Feng, Meng and Keten recently published their research in Cellulose, 1-11. [https://doi.org/10.1007/s10570-017-1367-x].
Lattice Parameter Misfit Evolution During Creep of a Cobalt-Based Superalloy Single Crystal With Cuboidal and Rafted Gamma-Prime Microstructures
Nov 17, 2017
Coakley, Lass, Ma, Frost, Stone, Sideman and Dunand published their research in Acta Materialia 136, 118–125 (2017). doi.org/10.1016/j.actamat.2017.06.025
Truly Electroforming-Free and Low-Energy Memristors with Preconditioned Conductive Tunneling Paths
Nov 17, 2017
Yoon, Zhang, Ren, Wang, Wu., Li, Barnell, Wu, Lauhon, Xia and Yang published their research in Advanced Functional Materials, 27, 1702010 (2017). DOI: 10.1002/adfm.201702010
Anomalous Phase Behavior of Ionic Polymer Blends and Ionic Copolymers
Nov 17, 2017
Pryamitsyn, Kwon, Zwanikken, Olvera de la Cruz published their research in Macromolecules, 50(13):5194- 5207, 2017.
Auxetic Metamaterials From Disordered Networks
Nov 17, 2017
Reid, Pashine, Wozniak, Jaeger, Liu, Nagel and De Pablo published their research in arXiv:1710.02493
Truly Electroforming-Free and Low-Energy Memristors with Preconditioned Conductive Tunneling Paths.
Nov 17, 2017
Yoon, Zhang, Ren, Wang, Wu., Li., Barnell, Wu , Lauhon, Xia and Yang published their findings in Advanced Functional Materials. DOI:10.1002/adfm.201702010
Ferroelectric Transitions in Small Particles
Nov 17, 2017
Umantsev, Astakhov and Rodin published their findings in Ferroelectrics 2017, 515, 101–111 http://dx.doi.org/10.1080/00150193.2017.1367214
Solubility and Interfacial Segregation of Salts in Ternary Polyelectrolyte Blends
Nov 17, 2017
Kwon, Pryamitsyn, Zwanikken, Shull, and De la Cruz published their findings in Soft Matter, 13, 4830–4840 (2017). DOI: 10.1039/C7SM00570A
Propeller-Shaped Acceptors for High-Performance Non-Fullerene Solar Cells: Importance of the Rigidity of Molecular Geometry
Nov 17, 2017
Wu, Zhao, Yang, Sharapov, Cai, Li, Zhang, Neshchadin,Chen and Yu published their findings in Chemistry of Materials 29 (3), 1127-1133.
Multi-Physics Modeling of Single/Multiple-Track Defect Mechanisms in Electron Beam Selective Melting
Nov 17, 2017
Yan, W., Ge, W., Qian, Y., Lin, S., Zhou, B., Liu, W. K., & Wagner, G. J published their findings in Acta Materialia, 134, 324-333(2017). DOI: 10.1016/j.actamat.2017.05.061
Towards a Hybrid Human-Computer Scientific Information Extraction Pipeline
Nov 17, 2017
Tchoua, Chard, Audus, Ward, Lequieu, De Pablo, and Ian Foster published their findings in 2017 IEEE 13th International Conference on e-Science, Oct. 2017.
Predicting the Morphologies of ?’ Precipitates in Cobalt-Based Superalloys
Nov 15, 2017
Jokisaari, Naghavi, Wolverton, Voorhees, and Heinonen published their research in Acta Materiala. DOI: 10.1016/j.actamat.2017.09.003
Atom Probe Tomography Analysis of Ag Doping in 2D Layered Material (PbSe)5(Bi2Se3)3
Dec 1, 2016
Ren, Singh, Fang, Kanatzidis, Tavazza, Davydov, and Lauhon published their findings in Nano Lett., 2016, 16 (10), pp 6064–6069. DOI: 10.1021/acs.nanolett.6b02104
Gel Phase Formation in Dilute Triblock Copolyelectrolyte Complexes
Dec 1, 2016
Srivastava, Andreev, Levi, Goldfeld, Mao, Prabhu, de Pablo and Terrell published their findings in Nature Communications, 7, 14131(2016).DOI: 10.1038/ncomms14131
Analytical Model on Stress-Regulated Lithiation Kinetics and Fracture of Si-C Yolk-Shell Anodes for Lithium-Ion Batteries
Dec 1, 2016
Jia and Liu published their findings in Journal of the Electrochemical Society, 163 (6), A940-A946, (2016) DOI: 10.1149/2.0601606jes
Linking Process, Structure, Property, and Performance for Metal-Based Additive Manufacturing: Computational Approaches with Experimental Support
Dec 1, 2016
Smith, Xiong, Yan, Lin, Cheng, Kafka, Wagner, Jian and Liu published their findings in Computational Mechanics, DOI: 10.1007/s00466-015-1240-4.
Perspective: Evolutionary Design of Granular Media and Block Copolymer Patterns
Dec 1, 2016
H. M. Jaeger and J. J. de Pablo published their research in APL Materials 4, 053209 (2016). DOI:10.1063/1.4948270
Benchmark Problems for Numerical Implementations of Phase Field Modeling
Dec 1, 2016
Jokisaari, Voorhees, J. Guyer, Warren and Heinonen published their findings in Comp. Mat. Sci. 126, 139 (2017)., http://www.sciencedirect.com/science/article/pii/S0927025616304712 (DOI: 10.1016/j.cmmatsci.2016.09.022)
Dielectric Effects on the Ion Distribution Near a Janus Colloid, Soft Matter
Dec 1, 2016
Wu, Han and Luijten published their findings in the Soft Matter 2016. DOI: 10.1039/c6sm01675h
Influence of Ruthenium on Microstructural Evolution in a Model Co-Al-W Superalloy
Dec 1, 2016
Sauza, Bocchini, Dunand, Sideman published their research in Acta Materialia, Volume 117, 15 September 2016, Pages 135-145, ISSN 1359-6454, http://dx.doi.org/10.1016/j.actamat.2016.07.014.
First-principles Co Database: Energetics of Binary Co Alloys and Compounds.
Dec 1, 2016
Naghavi, Hegde, Saboo and Wolverton published their research in Acta Materialia (in press), DOI: 10.1016/j.actamat.2016.10.065
A General-Purpose Machine Learning Framework for Predicting Properties of Inorganic Materials
Dec 1, 2016
Ward, Agrawal, Choudhary and Wolverton published their research in npj Comput. Mater. 2, 16028 (2016). DOI: 10.1038/npjcompumats.2016.28
Characterization and Reconstruction of 3D Stochastic Microstructures Via Supervised Learning
Dec 1, 2016
Bostanabad, Chen and Apley published their research in Journal of Microscopy (2016). DOI: 10.1111/jmi.12441
Perspective: NanoMine: A Material Genome Approach for Polymer Nanocomposites Analysis and Design
Dec 1, 2016
Zhao, He, Xiaolin Li, Yichi Zhang, Linda S. Schadler, Wei Chen, and L. Catherine Brinson published their findings in APL Materials 4, no. 5 (2016): 053204. DOI: 10.1063/1.4943679.
Covalent Functionalization and Passivation of Exfoliated Black Phosphorus Via Aryl Diazonium Chemistry
Dec 1, 2016
Ryder, Wood, Wells, Yang, Jariwala, Marks, Schatz and Hersam published their findings in Nature Chemistry, 8, 597 (2016). DOI:10.1038/nchem.2505
Planarity and Multiple Components Promote Organic Photovoltaic Efficiency by Improving Electronic Transport
Dec 1, 2016
Golden, Reid, de Pablo, and Galli published their findings in Phys. Chem. Chem. Phys., 2016, Advance Article. DOI: 10.1039/C6CP04999K
Covalently Bound Clusters of Alpha-Substituted PDI-Rival Electron Acceptors to Fullerene for Organic Solar Cells
Dec 1, 2016
Wu, Zhao, Schneider, Chen, Yu published their research in Journal of the American Chemical Society, 2016,138 (23), pp 7248–7251 DOI:10.1021/jacs.6b03562.
Bithiophenesulfonamide Building Block for Pi-Conjugated Donor-Acceptor Semi-Conductors
Dec 1, 2016
Melkonyan, Zhao, Drees, Eastham, Leonardi, Butler, Chen, Yu, Chang, Ratner, Facchetti and Marks published their research in J. Am. Chem. Soc. 2016, 138, 6944-6947. DOI: 10.1021/jacs.6b03498.
Dynamics of Vacancies in Two-Dimensional Lennard-Jones Crystals
Jan 15, 2015
Yao and Olvera de la Cruz studied the dynamics of generic n-point vacancies in two-dimensional Lennard-Jones crystals in several thermodynamic states. Their results were recently published in Physical Review E.
A Machine Learning-based Design Representation Method for Designing Heterogeneous Microstructures
Sep 23, 2014
Chen and Choudhary research groups won the Best Paper award at 40th ASME Design Automation Conference with their work.
