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Materials Science

Working Paper

Multi- and In-Stabilities in Gas Partitioning Between Nanoporous Materials and Rubber Balloons

Cory Simon, carlo carraro

Version 1 posted 27 September 2018

527

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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

307

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Materials Science

Working Paper

Multi-fidelity Bayesian Optimization of Covalent Organic Frameworks for Xenon/Krypton Separations

Nickolas Gantzler, Aryan Deshwal, Janardhan Rao Doppa, Cory Simon

Version 2 posted 26 June 2023

586

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Theoretical and Computational Chemistry

Working Paper

Computationally predicting the performance of gas sensor arrays for anomaly detection

Paul Morris, Cory Simon

Version 1 posted 05 April 2024

117

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Theoretical and Computational Chemistry

Working Paper

Message Passing Neural Networks for Partial Charge Assignment to Metal-Organic Frameworks

Ali Raza, Arni Sturluson, Cory Simon, Xiaoli Fern

Version 1 posted 14 May 2020

854

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Theoretical and Computational Chemistry

Working Paper

Eigencages: Learning a Latent Space of Porous Cage Molecules

Arni Sturluson, Melanie T. Huynh, Arthur H. P. York, Cory Simon

Version 3 posted 14 November 2018

1,258

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Materials Science

Working Paper

Statistical Mechanical Model of Gas Adsorption in a Metal-Organic Framework Harboring a Rotaxane Molecular Shuttle

Jonathan Carney, David Roundy, Cory M. Simon

Version 2 posted 28 September 2020

919

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Materials Science

Working Paper

Recommendation System to Predict Missing Adsorption Properties of Nanoporous Materials

Arni Sturluson, Ali Raza, Grant D. McConachie, Daniel Siderius, Xiaoli Fern, Cory Simon

Version 4 posted 26 October 2021

1,537

Downloads

Theoretical and Computational Chemistry

Working Paper

PoreMatMod.jl: Julia package for in silico post-synthetic modification of crystal structure models

E. Adrian Henle, Nickolas Gantzler, Praveen K. Thallapally, Xiaoli Z. Fern, Cory M. Simon

Version 1 posted 06 October 2021

436

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Materials Chemistry

Working Paper

Computation-informed optimization of Ni(PyC)₂ functionalization for noble gas separations

Nickolas Gantzler, Min-Bum Kim, Alexander Robinson, Maxwell W. Terban, Sanjit Ghose, Robert E. Dinnebier, Arthur Henry York, Davide Tiana, Cory M. Simon, Praveen K. Thallapally

Version 1 posted 03 December 2021

460

Downloads

2

Citations

Refine Search

19 results in Cory Simon in Authors: Cory Simon

Multi- and In-Stabilities in Gas Partitioning Between Nanoporous Materials and Rubber Balloons

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

Multi-fidelity Bayesian Optimization of Covalent Organic Frameworks for Xenon/Krypton Separations

Computationally predicting the performance of gas sensor arrays for anomaly detection

Message Passing Neural Networks for Partial Charge Assignment to Metal-Organic Frameworks

Eigencages: Learning a Latent Space of Porous Cage Molecules

Statistical Mechanical Model of Gas Adsorption in a Metal-Organic Framework Harboring a Rotaxane Molecular Shuttle

Recommendation System to Predict Missing Adsorption Properties of Nanoporous Materials

PoreMatMod.jl: Julia package for in silico post-synthetic modification of crystal structure models

Computation-informed optimization of Ni(PyC)₂ functionalization for noble gas separations

19 results in Authors: Cory Simon