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Publication	Type	Year
Studying the Computational Performance of CSP Analysis on Heterogeneous Computing Platforms 18th International Conference on Numerical Combustion. Oscar Homero Diaz-Ibarra, Kyungjoo Kim, Cosmin Safta, Habib N. Najm	Conference Presentation – 2022 Conference Presentation	2022
Reverse-mode differentiation in arbitrary tensor network format: with application to supervised learning Journal of Machine Learning Research Cosmin Safta, John Davis Jakeman, Alex Gorodetsky https://www.osti.gov/search/identifier:1872019	Journal Article – 2022 Journal Article	2022
Quantifying Uncertainty in E3SM via Functional Tensor Network Approximations Siam Uq22 Cosmin Safta, John Davis Jakeman, Khachik Sargsyan	Conference Presentation – 2022 Conference Presentation	2022
Studying the Computational Performance of CSP Analysis on Heterogeneous Computing Platforms 18th International Conference on Numerical Combustion Oscar Homero Diaz-Ibarra, Kyungjoo Kim, Cosmin Safta, Habib N. Najm	Abstract – 2022 Abstract	2022
TChem ? An Open Source Computational Chemistry Software Library for Heterogeneous Computing Platforms Generalized aerosol/chemistry interface workshop Cosmin Safta, Oscar Homero Diaz-Ibarra, Kyungjoo Kim	Presentation (non-conference) – 2022 Presentation (non-conference)	2022
CSPlib - A Toolkit for the Analysis of ODE/DAE Dynamical Systems and Chemical Kinetic Models Oscar Homero Diaz-Ibarra, Kyungjoo Kim, Cosmin Safta, Habib N. Najm https://www.osti.gov/search/identifier:1855067	SAND Report – 2021 SAND Report	2021
Functional Tensor Network Approximations for E3SM Land Model AGU Fall Meeting 2021 Cosmin Safta, Khachik Sargsyan, John Davis Jakeman	Conference Presentation – 2021 Conference Presentation	2021
TChem v3.0 - A Software Toolkit for the Analysis of Complex Kinetic Models Cosmin Safta, Habib N. Najm, Oscar Homero Diaz-Ibarra, Kyungjoo Kim https://www.osti.gov/search/identifier:1829197	SAND Report – 2021 SAND Report	2021
Using computational singular perturbation as a diagnostic tool in ODE and DAE systems: a case study in heterogeneous catalysis Combustion Theory and Modelling Oscar Homero Diaz-Ibarra, Kyungjoo Kim, Cosmin Safta, Judit Zador, Habib N. Najm https://www.osti.gov/search/identifier:1834151	Journal Article – 2021 Journal Article	2021
Exascale Catalytic Chemistry (ECC) EFRC-Hub-CMS-CCS PI Meeting Habib N. Najm, Khachik Sargsyan, Kyungjoo Kim, C. Franklin Goldsmith, Richard H. West, Eric J. Bylaska, David H. Bross, Branko Ruscic, Cosmin Safta, Judit Zador, Christopher Blais, Katrn Blndal, Oscar Homero Diaz-Ibarra, Eric Hermes, Emily Mazeau	Conference Poster – 2021 Conference Poster	2021
Automatic Generation And Analysis Of Microkinetic Models Virtual EFRC-Hub-CMS-CCS PI Meeting Blais Christopher, Oscar Homero Diaz-Ibarra, Emily Mazeau, Maciej Gierada, Eric Hermes, Cosmin Safta, Kyungjoo Kim, Habib N. Najm, Eric J. Bylaska, Judit Zador, C. Franklin Goldsmith, Richard H. West	Conference Presentation – 2021 Conference Presentation	2021
ECC Abstracts for the EFRC-Hub-CMS-CCS PI Meeting EFRC-Hub-CMS-CCS PI Meeting Habib N. Najm, Khachik Sargsyan, Kyungjoo Kim, C. Franklin Goldsmith, Richard H. West, Eric J. Bylaska, David H. Bross, Branko Ruscic, Cosmin Safta, Judit Zador, Katrn Blndal, Chris Blais, Oscar Homero Diaz-Ibarra, Emily Mazeau, Maciej Gierada, Eric Hermes, Abhishek Bagusetty, Duo Song	Abstract – 2021 Abstract	2021
Exascale Catalytic Chemistry (ecc) Project DOE CTC PI Meeting Habib N. Najm, Khachik Sargsyan, Kyungjoo Kim, C. Franklin Goldsmith, Richard H. West, Eric J. Bylaska, David H. Bross, Branko Ruscic, Cosmin Safta, Judit Zador	Abstract – 2021 Abstract	2021
TChem ? An Open Source Computational Chemistry Software Library for Heterogeneous Computing Platforms 12th US National Combustion Meeting Cosmin Safta, Oscar Homero Diaz-Ibarra, Kyungjoo Kim, Habib N. Najm	Conference Presentation – 2021 Conference Presentation	2021
TChem - An Open Source Computational Chemistry Software Library for Heterogenous Computing Platforms US National Combustion Meeting Cosmin Safta, Oscar Homero Diaz-Ibarra, Habib N. Najm, Kyungjoo Kim https://www.osti.gov/search/identifier:1862775	Conference Paper – 2021 Conference Paper	2021
Low-Rank Tensor Network Approximations for Earth System Model Siam Cse 2021 Cosmin Safta, Khachik Sargsyan, John Davis Jakeman, Alex Arkady Gorodetsky https://www.osti.gov/search/identifier:1854317	Conference Presentation – 2021 Conference Presentation	2021
Polynomial Chaos Expansions for Discrete Random Variables in Cyber Security Emulytics Experiments SIAM Computational Science and Engineering Bert Debusschere, Gianluca Geraci, John Davis Jakeman, Cosmin Safta, Laura Painton Swiler https://www.osti.gov/search/identifier:1847628	Conference Presentation – 2021 Conference Presentation	2021
Constrained Gaussian Processes: A Survey SIAM Computational Science and Engineering Conference 2021 Laura Painton Swiler, Mamikon Gulian, Ari Louis Frankel, Cosmin Safta, John Davis Jakeman https://www.osti.gov/search/identifier:1847480	Conference Presentation – 2021 Conference Presentation	2021
CSPlib - A Software Toolkit for the Analysis of Dynamical Systems and Chemical Kinetic Models Oscar Homero Diaz-Ibarra, Kyungjoo Kim, Cosmin Safta, Habib N. Najm https://www.osti.gov/search/identifier:1810242	SAND Report – 2021 SAND Report	2021
A Survey of Constrained Gaussian Process Regression: Approaches and Implementation Challenges Journal of Machine Learning for Modeling and Computing Laura Painton Swiler, Mamikon Gulian, Ari Louis Frankel, Cosmin Safta, John Davis Jakeman https://www.osti.gov/search/identifier:1691455	Journal Article – 2020 Journal Article	2020
Predictive Skill of Deep Learning Models Trained on Limited Sequence Data Cosmin Safta, Kookjin Lee, Jaideep Ray https://www.osti.gov/search/identifier:1688570	SAND Report – 2020 SAND Report	2020
TChem v2.0 - A Software Toolkit for the Analysis of Complex Kinetic Models Cosmin Safta, Kyungjoo Kim, Oscar Homero Diaz-Ibarra, Habib N. Najm https://www.osti.gov/search/identifier:1688569	SAND Report – 2020 SAND Report	2020
Polynomial Chaos Expansions for Discrete Random Variables in Cyber Security Emulytics Experiments Siam Conference on Computational Science and Engineering Bert Debusschere, Gianluca Geraci, John Davis Jakeman, Cosmin Safta, Laura Painton Swiler	Abstract – 2020 Abstract	2020
LDRD Project Summary: Incorporating physical constraints into Gaussian process surrogate models Laura Painton Swiler, Mamikon Gulian, Ari Louis Frankel, John Davis Jakeman, Cosmin Safta https://www.osti.gov/search/identifier:1668928	SAND Report – 2020 SAND Report	2020
Sandia's Research in Support of COVID-19 Pandemic Response: Computing and Information Sciences Travis Ladell Bauer, Walter Eugene Beyeler, Patrick D. Finley, Robert Fredric Jeffers, Carl Damon Laird, Monear Makvandi, Alexander V. Outkin, Cosmin Safta, Katherine M. Simonson https://www.osti.gov/search/identifier:1661021	SAND Report – 2020 SAND Report	2020
Document Title	Type	Year

Results 1–25 of 88

Publications

Studying the Computational Performance of CSP Analysis on Heterogeneous Computing Platforms

Reverse-mode differentiation in arbitrary tensor network format: with application to supervised learning

Quantifying Uncertainty in E3SM via Functional Tensor Network Approximations

Studying the Computational Performance of CSP Analysis on Heterogeneous Computing Platforms

TChem ? An Open Source Computational Chemistry Software Library for Heterogeneous Computing Platforms

CSPlib - A Toolkit for the Analysis of ODE/DAE Dynamical Systems and Chemical Kinetic Models

Functional Tensor Network Approximations for E3SM Land Model

TChem v3.0 - A Software Toolkit for the Analysis of Complex Kinetic Models

Using computational singular perturbation as a diagnostic tool in ODE and DAE systems: a case study in heterogeneous catalysis

Exascale Catalytic Chemistry (ECC)

Automatic Generation And Analysis Of Microkinetic Models

ECC Abstracts for the EFRC-Hub-CMS-CCS PI Meeting

Exascale Catalytic Chemistry (ecc) Project

TChem ? An Open Source Computational Chemistry Software Library for Heterogeneous Computing Platforms

TChem - An Open Source Computational Chemistry Software Library for Heterogenous Computing Platforms

Low-Rank Tensor Network Approximations for Earth System Model

Polynomial Chaos Expansions for Discrete Random Variables in Cyber Security Emulytics Experiments

Constrained Gaussian Processes: A Survey

CSPlib - A Software Toolkit for the Analysis of Dynamical Systems and Chemical Kinetic Models

A Survey of Constrained Gaussian Process Regression: Approaches and Implementation Challenges

Predictive Skill of Deep Learning Models Trained on Limited Sequence Data

TChem v2.0 - A Software Toolkit for the Analysis of Complex Kinetic Models

Polynomial Chaos Expansions for Discrete Random Variables in Cyber Security Emulytics Experiments

LDRD Project Summary: Incorporating physical constraints into Gaussian process surrogate models

Sandia's Research in Support of COVID-19 Pandemic Response: Computing and Information Sciences