The Solution is the Solution: Data-Driven Elucidation of Solution-to-Device Feature Transfer for π-Conjugated Polymer Semiconductors

Elucidating the Full Potential of OPV Materials Utilizing a High-Throughput Robot-Based Platform and Machine Learning

(2021) Xiaoyan Du et al.   Joule

Characterizing polymer structure with small-angle neutron scattering: A Tutorial

(2021) Yuan Wei et al.   JOURNAL OF APPLIED PHYSICS

OCELOT: An infrastructure for data-driven research to discover and design crystalline organic semiconductors

(2021) Qianxiang Ai et al.   JOURNAL OF CHEMICAL PHYSICS

Thermomechanical enhancement of DPP‐4T through purposeful π‐conjugation disruption

(2021) Connor P. Callaway et al.   JOURNAL OF POLYMER SCIENCE

Beyond Ternary OPV: High‐Throughput Experimentation and Self‐Driving Laboratories Optimize Multicomponent Systems

(2020) Stefan Langner et al.   ADVANCED MATERIALS

Self-driving laboratory for accelerated discovery of thin-film materials

(2020) B. P. MacLeod et al.   Science Advances

Systematic Study on the Morphological Development of Blade-Coated Conjugated Polymer Thin Films via In Situ Measurements

(2020) Yeon-Ju Kim et al.   ACS Applied Materials & Interfaces

Artificial Chemist: An Autonomous Quantum Dot Synthesis Bot

(2020) Robert W. Epps et al.   ADVANCED MATERIALS

Developing molecular-level models for organic field-effect transistors

(2020) Haoyuan Li et al.   National Science Review

Nanostructure of organic semiconductor thin films: Molecular dynamics modeling with solvent evaporation

(2020) Anders S. Gertsen et al.   Physical Review Materials

High‐Throughput Characterization of Perovskite Solar Cells for Rapid Combinatorial Screening

(2020) Maciej Adam Surmiak et al.   Solar RRL

Evolution and Morphology of Thin Films Formed by Solvent Evaporation: An Organic Semiconductor Case Study

(2020) Thomas Lee et al.   ACS Applied Materials & Interfaces

Chain Conformation and Aggregation Structure Formation of a High Charge Mobility DPP-Based Donor–Acceptor Conjugated Polymer

(2020) Chang Liu et al.   MACROMOLECULES

ATSAS 3.0: expanded functionality and new tools for small-angle scattering data analysis

(2020) Karen Manalastas-Cantos et al.   JOURNAL OF APPLIED CRYSTALLOGRAPHY

What Is the Assembly Pathway of a Conjugated Polymer From Solution to Thin Films?

(2020) Zhuang Xu et al.   Frontiers in Chemistry

Recent Progress in Inkjet-Printed Thin-Film Transistors

(2019) Seungjun Chung et al.   Advanced Science

Donor–Acceptor‐Conjugated Polymer for High‐Performance Organic Field‐Effect Transistors: A Progress Report

(2019) Minjun Kim et al.   ADVANCED FUNCTIONAL MATERIALS

Data‐Driven Materials Science: Status, Challenges, and Perspectives

(2019) Lauri Himanen et al.   Advanced Science

Tuning conformation, assembly, and charge transport properties of conjugated polymers by printing flow

(2019) Kyung Sun Park et al.   Science Advances

Big Data Creates New Opportunities for Materials Research: A Review on Methods and Applications of Machine Learning for Materials Design

(2019) Teng Zhou et al.   Engineering

Control of Nucleation Density in Conjugated Polymers via Seed Nucleation

(2019) Michael McBride et al.   ACS Applied Materials & Interfaces

Understanding the Meniscus‐Guided Coating Parameters in Organic Field‐Effect‐Transistor Fabrications

(2019) Ming Chen et al.   ADVANCED FUNCTIONAL MATERIALS

Efficient Exploration of the Composition Space in Ternary Organic Solar Cells by Combining High‐Throughput Material Libraries and Hyperspectral Imaging

(2019) Albert Harillo‐Baños et al.   Advanced Energy Materials

Toward data-enabled process optimization of deformable electronic polymer-based devices

(2019) Michael McBride et al.   Current Opinion in Chemical Engineering

The meniscus-guided deposition of semiconducting polymers

(2018) Xiaodan Gu et al.   Nature Communications

A Small-Angle Neutron Scattering Environment for In-Situ Observation of Chemical Processes

(2018) Dominic W. Hayward et al.   Scientific Reports

High-Throughput Multiparametric Screening of Solution Processed Bulk Heterojunction Solar Cells

(2018) Antonio Sánchez-Díaz et al.   Advanced Electronic Materials

Accelerating the discovery of materials for clean energy in the era of smart automation

(2018) Daniel P. Tabor et al.   Nature Reviews Materials

Aggregation and Solubility of a Model Conjugated Donor–Acceptor Polymer

(2018) Daniel R. Reid et al.   Journal of Physical Chemistry Letters

Machine learning for molecular and materials science

(2018) Keith T. Butler et al.   NATURE

Wafer‐Scale Fabrication of High‐Performance n‐Type Polymer Monolayer Transistors Using a Multi‐Level Self‐Assembly Strategy

(2018) Ze‐Fan Yao et al.   ADVANCED MATERIALS

Modeling organic electronic materials: bridging length and time scales

(2017) Thomas F. Harrelson et al.   MOLECULAR SIMULATION

A comprehensive review on poly(3-alkylthiophene)-based crystalline structures, protocols and electronic applications

(2017) Samira Agbolaghi et al.   ORGANIC ELECTRONICS

Highly stretchable polymer semiconductor films through the nanoconfinement effect

(2017) Jie Xu et al.   SCIENCE

Recent progress in the development of n-type organic semiconductors for organic field effect transistors

(2017) Jesse T. E. Quinn et al.   Journal of Materials Chemistry C

Fulfilling the promise of the materials genome initiative with high-throughput experimental methodologies

(2017) M. L. Green et al.   Applied Physics Reviews

ATSAS 2.8: a comprehensive data analysis suite for small-angle scattering from macromolecular solutions

(2017) D. Franke et al.   JOURNAL OF APPLIED CRYSTALLOGRAPHY

Controlling the Surface Organization of Conjugated Donor-Acceptor Polymers by their Aggregation in Solution

(2016) Mengmeng Li et al.   ADVANCED MATERIALS

Ordering of Poly(3-hexylthiophene) in Solutions and Films: Effects of Fiber Length and Grain Boundaries on Anisotropy and Mobility

(2016) Nabil Kleinhenz et al.   CHEMISTRY OF MATERIALS

Silicon Valley meets the ivory tower: Searchable data repositories for experimental nanomaterials research

(2016) Nils Persson et al.   CURRENT OPINION IN SOLID STATE & MATERIALS SCIENCE

Solvent-Dependent Structure Formation in Drying P3HT:PCBM Films Studied by Molecular Dynamics Simulations

(2016) Vikas Negi et al.   MACROMOLECULAR THEORY AND SIMULATIONS

Exploring the origin of high optical absorption in conjugated polymers

(2016) Michelle S. Vezie et al.   NATURE MATERIALS

Avoid the kinks when measuring mobility

(2016) I. McCulloch et al.   SCIENCE

The FAIR Guiding Principles for scientific data management and stewardship

(2016) Mark D. Wilkinson et al.   Scientific Data

Solution-Processed Donor-Acceptor Polymer Nanowire Network Semiconductors For High-Performance Field-Effect Transistors

(2016) Yanlian Lei et al.   Scientific Reports

Charge-Transport Anisotropy in a Uniaxially Aligned Diketopyrrolopyrrole-Based Copolymer

(2015) Sam Schott et al.   ADVANCED MATERIALS

High-Performance Organic Field-Effect Transistors with Directionally Aligned Conjugated Polymer Film Deposited from Pre-Aggregated Solution

(2015) Nam-Koo Kim et al.   CHEMISTRY OF MATERIALS

Best Practices for Reporting Organic Field Effect Transistor Device Performance

(2015) Dalsu Choi et al.   CHEMISTRY OF MATERIALS

Temperature-dependent orientation study of the initial growth of pentacene on amorphous SiO 2 by molecular dynamics simulations

(2015) Yuanqi Zeng et al.   JOURNAL OF CRYSTAL GROWTH

Entanglements in marginal solutions: a means of tuning pre-aggregation of conjugated polymers with positive implications for charge transport

(2015) Hanlin Hu et al.   Journal of Materials Chemistry C

25th Anniversary Article: Organic Field-Effect Transistors: The Path Beyond Amorphous Silicon

(2014) Henning Sirringhaus   ADVANCED MATERIALS

Morphology control strategies for solution-processed organic semiconductor thin films

(2014) Ying Diao et al.   Energy & Environmental Science

Recent progress of high performance polymer OLED and OPV materials for organic printed electronics

(2014) Chizu Sekine et al.   SCIENCE AND TECHNOLOGY OF ADVANCED MATERIALS

Advances in Charge Carrier Mobilities of Semiconducting Polymers Used in Organic Transistors

(2013) Sarah Holliday et al.   CHEMISTRY OF MATERIALS

Lead candidates for high-performance organic photovoltaics from high-throughput quantum chemistry – the Harvard Clean Energy Project

(2013) Johannes Hachmann et al.   Energy & Environmental Science

Enhanced Solid-State Order and Field-Effect Hole Mobility through Control of Nanoscale Polymer Aggregation

(2013) Mark S. Chen et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

All-Atom Molecular Dynamics Simulation of Temperature Effects on the Structural, Thermodynamic, and Packing Properties of the Pure Amorphous and Pure Crystalline Phases of Regioregular P3HT

(2013) Orestis Alexiadis et al.   MACROMOLECULES

Small Angle X-Ray Scattering Studies of Mitochondrial Glutaminase C Reveal Extended Flexible Regions, and Link Oligomeric State with Enzyme Activity

(2013) Magda Møller et al.   PLoS One

Recent Advances in the Development of Semiconducting DPP-Containing Polymers for Transistor Applications

(2012) Christian B. Nielsen et al.   ADVANCED MATERIALS

Molecular dynamics simulations of organic photovoltaic materials: Investigating the formation of π-stacked thiophene clusters in oligothiophene/fullerene blends

(2012) S.Y. Reddy et al.   SYNTHETIC METALS

Microfluidic Arrays for Rapid Characterization of Organic Thin-Film Transistor Performance

(2011) Christopher J. Bettinger et al.   ADVANCED MATERIALS

Application of Molecular Simulation Techniques to the Study of Factors Affecting the Thin-Film Morphology of Small-Molecule Organic Semiconductors†

(2011) Paulette Clancy   CHEMISTRY OF MATERIALS

Accelerated computational discovery of high-performance materials for organic photovoltaics by means of cheminformatics

(2011) Roberto Olivares-Amaya et al.   Energy & Environmental Science

The Harvard Clean Energy Project: Large-Scale Computational Screening and Design of Organic Photovoltaics on the World Community Grid

(2011) Johannes Hachmann et al.   Journal of Physical Chemistry Letters

π-Conjugated Polymers for Organic Electronics and Photovoltaic Cell Applications†

(2010) Antonio Facchetti   CHEMISTRY OF MATERIALS

Hybrid Solvents Incubated π−π Stacking in Quenched Conjugated Polymer Resolved by Multiscale Computation

(2010) Cheng K. Lee et al.   MACROMOLECULES

Determining exciton bandwidth and film microstructure in polythiophene films using linear absorption spectroscopy

(2009) Jenny Clark et al.   APPLIED PHYSICS LETTERS

Robust, high-throughput solution structural analyses by small angle X-ray scattering (SAXS)

(2009) Greg L Hura et al.   NATURE METHODS

High-Throughput Small Angle X-ray Scattering from Proteins in Solution Using a Microfluidic Front-End

(2008) K. Nørgaard Toft et al.   ANALYTICAL CHEMISTRY