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Physical Chemistry

Working Paper

Rediscovering the particle in a box: Machine learning regression analysis for hypothesis generation in physical chemistry lab

Elizabeth Thrall, Fernando Martinez Lopez, Thomas Egg, Seung Eun Lee, Joshua Schrier, Yijun Zhao

Version 2 posted 03 October 2023

449

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Materials Chemistry

Review

In Pursuit of the Exceptional: Research Directions for Machine Learning in Chemical and Materials Science

Joshua Schrier, Alexander Norquist, Tonio Buonassisi, Jakoah Brgoch

Version 2 posted 21 August 2023

1,371

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Inorganic Chemistry

Working Paper

A spatiotemporal route to understanding metal halide perovskite crystallization

Mansoor Ani Najeeb, Rodolfo Keesey, Margaret Zeile, Venkateswaran Shekar, Zhi Li, Nicholas Leiby, Matthias Zeller, Emory Chan, Joshua Schrier, Alexander Norquist

Version 1 posted 28 January 2022

310

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Materials Science

Working Paper

Dimensional control over metal halide perovskite crystallization guided by active learning

Zhi Li, Philip Nega, Mansoor Najeeb, Chaochao Dun, Matthias Zeller, Jeffrey Urban, Wissam Saidi, Joshua Schrier, Alexander Norquist, Emory Chan

Version 1 posted 04 October 2021

583

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Physical Chemistry

Working Paper

Data-driven imputation of miscibility of aqueous solutions via graph-regularized logistic matrix factorization

Diba Behnoudfar, Cory Simon, Joshua Schrier

Version 2 posted 21 August 2023

305

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Chemical Education

Working Paper

Machine learning for functional group identification in vibrational spectroscopy: A pedagogical lab for undergraduate chemistry students

Elizabeth Thrall, Seung Eun Lee, Joshua Schrier, Yijun Zhao

Version 1 posted 22 June 2021

433

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Materials Chemistry

Working Paper

Environmental Stability of Crystals: Why Be Greedy When You Can Be Exact?

Qianxiang Ai, Joshua Schrier

Version 1 posted 02 June 2022

204

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Materials Chemistry

Review

Serendipity based recommender system for perovskites material discovery: balancing exploration and exploitation across multiple models

Venkateswaran Shekar, Vincent Yu, Benjamin J. Garcia, David Benjamin Gordon, Gemma E. Moran, David M. Blei, Loïc M. Roch, Alberto García-Durán, Mansoor Ani Najeeb, Margaret Zeile, Philip W. Nega, Zhi Li, Mina A. Kim, Emory M. Chan, Alexander J. Norquist, Sorelle Friedler, Joshua Schrier

Version 2 posted 20 July 2022

984

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3

Citations

Chemical Education

Review

Review of Low-cost Self-driving Laboratories: The "Frugal Twin" Concept

Stanley Lo, Sterling Baird, Joshua Schrier, Ben Blaiszik, Nessa Carson, Ian Foster, Andrés Aguilar-Granda, Sergei Kalinin, Benji Maruyama, Maria Politi, Helen Tran, Taylor Sparks, Alán Aspuru-Guzik

Version 2 posted 16 November 2023

1,309

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1

Citations

Materials Science

Working Paper

Robot-Accelerated Perovskite Investigation and Discovery (RAPID): 1. Inverse Temperature Crystallization

Zhi Li, Mansoor Ani Najeeb, Liana Alves, Alyssa Sherman, Peter Cruz Parrilla, Ian M. Pendleton, Matthias Zeller, Joshua Schrier, Alexander J. Norquist, Emory Chan

Version 1 posted 24 October 2019

1,541

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1

Citations

Refine Search

18 results in Joshua Schrier in Authors: Joshua Schrier

Rediscovering the particle in a box: Machine learning regression analysis for hypothesis generation in physical chemistry lab

In Pursuit of the Exceptional: Research Directions for Machine Learning in Chemical and Materials Science

A spatiotemporal route to understanding metal halide perovskite crystallization

Dimensional control over metal halide perovskite crystallization guided by active learning

Data-driven imputation of miscibility of aqueous solutions via graph-regularized logistic matrix factorization

Machine learning for functional group identification in vibrational spectroscopy: A pedagogical lab for undergraduate chemistry students

Environmental Stability of Crystals: Why Be Greedy When You Can Be Exact?

Serendipity based recommender system for perovskites material discovery: balancing exploration and exploitation across multiple models

Review of Low-cost Self-driving Laboratories: The "Frugal Twin" Concept

Robot-Accelerated Perovskite Investigation and Discovery (RAPID): 1. Inverse Temperature Crystallization

18 results in Authors: Joshua Schrier