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Theoretical and Computational Chemistry

Working Paper

A Data-Driven Perspective on the Colours of Metal-Organic Frameworks

Kevin Maik Jablonka, Seyed Mohamad Moosavi, Mehrdad Asgari, Christopher Ireland, Luc Patiny, Berend Smit

Version 1 posted 01 October 2020

644

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Inorganic Chemistry

Working Paper

Understanding the Diversity of the Metal-Organic Framework Ecosystem

Seyed Mohamad Moosavi, Aditya Nandy, Kevin Maik Jablonka, Daniele Ongari, Jon Paul Janet, Peter G. Boyd, Yongjin Lee, Berend Smit, Heather Kulik

Version 1 posted 07 May 2020

1,085

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1

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Theoretical and Computational Chemistry

Working Paper

Using Collective Knowledge to Assign Oxidation States

Kevin Maik Jablonka, Daniele Ongari, Seyed Mohamad Moosavi, Berend Smit

Version 1 posted 17 January 2020

2,262

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6

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Organic Chemistry

Working Paper

Geometric Landscapes for Material Discovery within Energy-Structure-Function Maps

Seyed Mohamad Moosavi, Henglu Xu, Linjiang Chen, Andrew I. Cooper, Berend Smit

Version 1 posted 07 February 2020

931

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Energy

Working Paper

Shedding Light on the Stakeholders' Perspectives for Carbon Capture

Charithea Charalambous, Elias Moubarak, Johannes Schilling, Eva Sanchez Fernandez, Jin-Yu Wang, Laura Herraiz, Fergus Mcilwaine, Kevin Maik Jablonka, Seyed Mohamad Moosavi, Joren Van Herck, Georges Mouchaham, Christian Serre, André Bardow, Berend Smit, Susana Garcia

Version 1 posted 20 June 2023

1,692

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5

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Materials Chemistry

Working Paper

A Data-Science Approach to Predict the Heat Capacity of Nanoporous Materials

Seyed Mohamad Moosavi, Balázs Álmos Novotny, Daniele Ongari, Elias Moubarak, Mehrdad Asgari, Özge Kadioglu, Charithea Charalambous, Andres Guerrero, Amir H. Farmahini, Lev Sarkisov, Susana Garcia, Frank Noé, Berend Smit

Version 1 posted 19 April 2022

1,474

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Theoretical and Computational Chemistry

Working Paper

Inverse Design of Porous Materials: A Diffusion Model Approach

Junkil Park, Aseem Partap Singh Gill, Seyed Mohamad Moosavi, JIHAN KIM

Version 1 posted 18 July 2023

1,055

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1

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Materials Chemistry

Working Paper

MOF-ChemUnity: Unifying metal-organic framework data using large language models

Thomas Michael Pruyn, Amro Aswad, Sartaaj Takrim Khan, Robert Black, Seyed Mohamad Moosavi

Version 1 posted 03 June 2025

713

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Chemical Engineering and Industrial Chemistry

Working Paper

Thermodynamics-informed machine learning for predicting temperature-dependent chemical properties

Mahyar Rajabi Kochi, Hanie Rezaei, Sartaaj Takrim Khan, Bhanu Teja Mamillapalli, Maryam Ebrahimiazar, Haoming Ye, Rose Moosavian, Mohammad Zargartalebi, David Sinton, Seyed Mohamad Moosavi

Version 1 posted 03 June 2025

363

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Chemical Engineering and Industrial Chemistry

Working Paper

Adaptive Representation of Molecules and Materials in Bayesian Optimization

Mahyar Rajabi Kochi, Negareh Mahboubi, Aseem Partap Singh Gill, Seyed Mohamad Moosavi

Version 1 posted 15 November 2024

357

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Refine Search

15 results in Seyed Mohamad Moosavi in Authors: Seyed Mohamad Moosavi

A Data-Driven Perspective on the Colours of Metal-Organic Frameworks

Understanding the Diversity of the Metal-Organic Framework Ecosystem

Using Collective Knowledge to Assign Oxidation States

Geometric Landscapes for Material Discovery within Energy-Structure-Function Maps

Shedding Light on the Stakeholders' Perspectives for Carbon Capture

A Data-Science Approach to Predict the Heat Capacity of Nanoporous Materials

Inverse Design of Porous Materials: A Diffusion Model Approach

MOF-ChemUnity: Unifying metal-organic framework data using large language models

Thermodynamics-informed machine learning for predicting temperature-dependent chemical properties

Adaptive Representation of Molecules and Materials in Bayesian Optimization

15 results in Authors: Seyed Mohamad Moosavi