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Theoretical and Computational Chemistry

Working Paper

Martini on the Rocks: Can a Coarse-Grained Force Field Model Crystals?

A. Najla Hosseini, David van der Spoel

Version 1 posted 02 January 2024

180

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Physical Chemistry

Working Paper

The Calculation of the Infrared and Terahertz Spectrum of Sodium Peroxodisulfate.

John Kendrick, Andrew Burnett

Version 1 posted 05 July 2019

683

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Physical Chemistry

Working Paper

Edge-to-Center Propagation of Photochemical Reaction during Single-Crystal-to-Single-Crystal Photomechanical Transformation of 2,5-Distyrylpyrazine Crystals

Kohei Morimoto, Daichi Kitagawa, Hikaru Sotome, Syoji Ito, Hiroshi Miyasaka, Seiya Kobatake

Version 3 posted 19 August 2022

509

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Materials Chemistry

Working Paper

Photoinduced Crystal Melting with Luminescence Evolution Based on Conformational Isomerisation

Mao Komura, Hikaru Sotome, Hiroshi Miyasaka, Takuji Ogawa, Yosuke Tani

Version 2 posted 14 February 2023

403

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Inorganic Chemistry

Working Paper

Isolation of a Californium(II) Crown-Ether Complex

Todd Poe, Harry Ramanantoanina, Joseph Sperling, Hannah Wineinger, Brian Rotermund, Jacob Brannon, Zhuanling Bai, Benjamin Scheibe, Nicholas Beck, Brian Long, Samantha Justiniano, Thomas Albrecht-Schoenzart, Cristian Celis-Barros

Version 1 posted 22 June 2022

445

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Inorganic Chemistry

Working Paper

Porous soft materials with liquid-glass-crystal interconvertibility based on metal-organic polyhedra

Po-Chun Han, Chia-Hui Chuang, Shang-Wei Lin, Zaoming Wang, Mako Kuzumoto, Xiangmei Xiang, Shun Tokuda, Tomoki Tateishi, Alexandre Legrand, Min Ying Tsang, Hsiao-Ching Yang, Kevin C.-W. Wu, Kenji Urayama, Dun-Yen Kang, Shuhei Furukawa

Version 1 posted 10 January 2024

601

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1

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Organic Chemistry

Working Paper

Polymorphism and flexibility of six-porphyrin nanorings in the solid state

Harry Anderson, Wojciech Stawski

Version 1 posted 16 August 2024

371

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7 results in Crystal in Keywords: Crystal

Martini on the Rocks: Can a Coarse-Grained Force Field Model Crystals?

The Calculation of the Infrared and Terahertz Spectrum of Sodium Peroxodisulfate.

Edge-to-Center Propagation of Photochemical Reaction during Single-Crystal-to-Single-Crystal Photomechanical Transformation of 2,5-Distyrylpyrazine Crystals

Photoinduced Crystal Melting with Luminescence Evolution Based on Conformational Isomerisation

Isolation of a Californium(II) Crown-Ether Complex

Porous soft materials with liquid-glass-crystal interconvertibility based on metal-organic polyhedra

Polymorphism and flexibility of six-porphyrin nanorings in the solid state

7 results in Keywords: Crystal