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Chemistry

Working Paper

Predicting Elemental Boiling Points from First Principles

Jan-Michael Mewes, Odile Smits

Version 4 posted 11 September 2020

1,657

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Chemistry

Working Paper

Observation of the Reversible Ice III to Ice IX Phase Transition by Using Ammonium Fluoride as Anti-Ice II Agent

Christoph Salzmann, Zainab Sharif, Ben Slater, Craig L. Bull, Martin Hart

Version 1 posted 09 October 2020

651

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Chemistry

Working Paper

Phase Stability of the Tin Monochalcogenides SnS and SnSe: A Quasi-Harmonic Lattice-Dynamics Study

Ioanna Pallikara, Jonathan Skelton

Version 3 posted 19 August 2021

1,764

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Chemistry

Working Paper

Alloy CsCdxPb1-xBr3 Perovskite Nanocrystals: The Role of Surface Passivation in Preserving Composition and Blue Emission

Muhammad Imran, Julien Ramade, Francesco Di Stasio, Manuela De Franco, Joka Buha, Sandra Van Aert, Luca Goldoni, Simone Lauciello, Mirko Prato, Ivan Infante, Sara Bals, Liberato Manna

Version 1 posted 24 August 2020

1,172

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Chemistry

Working Paper

Environment-Controlled Post-Synthetic Modifications of Iron Formate Frameworks

Szymon Sobczak, Andrzej Katrusiak

Version 1 posted 04 March 2019

955

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Chemistry

Working Paper

Logic and Symbolism of Switchable Porous Framework Materials

Leila Abylgazina, Irena Senkovska, Stefan Kaskel

Version 1 posted 21 January 2021

721

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6

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Chemistry

Working Paper

Molecular Dynamics Simulations of the “Breathing” Phase Transformation of MOF Nanocrystallites

Julian Keupp, Rochus Schmid

Version 1 posted 17 June 2019

1,625

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1

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Chemistry

Working Paper

Ferroic Multipolar Order and Disorder in Cyanoelpasolite Molecular Perovskites

Chloe Coates, Harry Gray, Johnathan Bulled, Hanna Boström, Arkadiy Simonov, Andrew Goodwin

Version 1 posted 19 November 2018

990

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Chemistry

Working Paper

Unraveling the Nature of Pressure-Induced Phases of MAPbBr3 by ab initio Molecular Dynamics

Sayan Maity, Suraj Verma, Lavanya M. Ramaniah, Varadharajan Srinivasan

Version 3 posted 17 March 2023

859

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Chemistry

Working Paper

Lithium and Sodium Benzimidazolate Coordination Networks: Syntheses, Structures and Thermal Properties

Pascal Kolodzeiski, Erik Svensson Grape, Roman Pallach, Lennard Richter, A. Ken Inge, Sebastian Henke

Version 1 posted 07 August 2024

470

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41 results in Phase Transitions in Keywords: Phase Transitions

Predicting Elemental Boiling Points from First Principles

Observation of the Reversible Ice III to Ice IX Phase Transition by Using Ammonium Fluoride as Anti-Ice II Agent

Phase Stability of the Tin Monochalcogenides SnS and SnSe: A Quasi-Harmonic Lattice-Dynamics Study

Alloy CsCdxPb1-xBr3 Perovskite Nanocrystals: The Role of Surface Passivation in Preserving Composition and Blue Emission

Environment-Controlled Post-Synthetic Modifications of Iron Formate Frameworks

Logic and Symbolism of Switchable Porous Framework Materials

Molecular Dynamics Simulations of the “Breathing” Phase Transformation of MOF Nanocrystallites

Ferroic Multipolar Order and Disorder in Cyanoelpasolite Molecular Perovskites

Unraveling the Nature of Pressure-Induced Phases of MAPbBr3 by ab initio Molecular Dynamics

Lithium and Sodium Benzimidazolate Coordination Networks: Syntheses, Structures and Thermal Properties

41 results in Keywords: Phase Transitions