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Inverse Design of Nanoporous Crystalline Reticular Materials with Deep Generative Models

Zhenpeng Yao, Benjamin Sanchez-Lengeling, N. Scott Bobbitt, Benjamin J. Bucior, Sai Govind Hari Kumar, Sean P. Collins, Thomas Burns, Tom K. Woo, Omar Farha, Randall Q. Snurr, Alan Aspuru-Guzik

Version 2 posted 25 August 2020

5,751

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Materials Science

Working Paper

Quadrupole Interaction of the SrTiO3:V4+ System

Thomas (Tom) Kool

Version 1 posted 23 October 2018

668

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Materials Science

Working Paper

The tetragonal elastic dipole Cr5+ in SrTiO3

Thomas (Tom) Kool

Version 2 posted 02 April 2018

1,146

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Organic Chemistry

Working Paper

Manganese-Catalyzed Electrochemical Deconstructive Chlorination of Cycloalkanols via Alkoxy Radicals

Benjamin D. W. Allen, Mishra Deepak Hareram, Alex C. Seastram, Tom McBride, Thomas Wirth, Duncan L. Browne, Louis C. Morrill

Version 1 posted 07 August 2019

916

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1

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Chemical Engineering and Industrial Chemistry

Working Paper

Hybrid model development emulating linear polarization resistance method towards optimizing dosages of corrosion inhibitors

Chamanthi Denisha Jayaweera, Ivaylo Hitsov, David Fernandes del Pozo, Elias De Ketelaere, Tom Depover, Sarah Müller, Thomas Diekow, Arne Verliefde, Ingmar Nopens

Version 1 posted 28 October 2024

59

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Materials Science

Working Paper

Non-covalent Functionalized Schottky Interface at Ti3C2Tx/n-Si Van der Waals Heterojunction

Eloi Ros Costals, Xavier Francesc Cappela, Thomas Tom, Sergio Giraldo, Marcel Placidi, Cristobal Voz, Joaquim Puigdollers, Edgardo Saucedo, Zacharie Jehl Li Kao, Kunal Jogendra Tiwari

Version 2 posted 28 November 2023

215

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Organic Chemistry

Working Paper

Rational Design of Amphiphilic Fluorinated Peptides: Evaluation of Self-Assembly Properties and Hydrogel Formation

Suvrat Chowdhary, Robert Franz Schmidt, Anil Kumar Sahoo, Tiemo tom Dieck, Thomas Hohmann, Boris Schade, Kerstin Brademann-Jock, Andreas F. Thünemann, Roland R. Netz, Michael Gradzielski, Beate Koksch

Version 2 posted 25 March 2022

521

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Materials Science

Working Paper

Principles of Melting in Hybrid Organic-Inorganic Perovskite and Polymorphic ABX3 Structures

Bikash Kumar Shaw, Celia Castillo-Blas, Michael Thorne, Maria Laura Rios Gómez, Tom Forrest, Maria Diaz Lopez, Philip Chater, Lauren McHugh, David Keen, thomas bennett

Version 1 posted 28 July 2021

252

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Materials Science

Working Paper

Rhombic Fe3+ at the unpolished surface of single crystals SrTiO3

Thomas (Tom) Kool

Version 1 posted 30 January 2018

696

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Biological and Medicinal Chemistry

Working Paper

Development of Inhibitors Against Mycobacterium Abscessus tRNA (m1G37) Methyltransferase (TrmD) Using Fragment-Based Approaches

Andrew J. Whitehouse, Sherine E. Thomas, Karen P. Brown, Alexander Fanourakis, Daniel Chan, M. Daben J. Libardo, Vitor Mendes, Helena I. M. Boshoff, R. Andres Floto, Chris Abell, Tom. L. Blundell, Anthony Coyne

Version 1 posted 16 May 2019

590

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10 results in Thomas Tom in Authors: Thomas Tom

Inverse Design of Nanoporous Crystalline Reticular Materials with Deep Generative Models

Quadrupole Interaction of the SrTiO3:V4+ System

The tetragonal elastic dipole Cr5+ in SrTiO3

Manganese-Catalyzed Electrochemical Deconstructive Chlorination of Cycloalkanols via Alkoxy Radicals

Hybrid model development emulating linear polarization resistance method towards optimizing dosages of corrosion inhibitors

Non-covalent Functionalized Schottky Interface at Ti3C2Tx/n-Si Van der Waals Heterojunction

Rational Design of Amphiphilic Fluorinated Peptides: Evaluation of Self-Assembly Properties and Hydrogel Formation

Principles of Melting in Hybrid Organic-Inorganic Perovskite and Polymorphic ABX3 Structures

Rhombic Fe3+ at the unpolished surface of single crystals SrTiO3

Development of Inhibitors Against Mycobacterium Abscessus tRNA (m1G37) Methyltransferase (TrmD) Using Fragment-Based Approaches

10 results in Authors: Thomas Tom