Mechanistic Investigation of an Elastically Flexible Organic Crystal

Torvid Feiler; Nobuhiro Yasuda; Adam A. L. Michalchuk; Franziska Emmerling; Biswajit Bhattacharya

doi:10.1021/acs.cgd.3c00473

Mechanistic Investigation of an Elastically Flexible Organic Crystal

Torvid Feiler, Nobuhiro Yasuda, Adam A. L. Michalchuk^*, Franziska Emmerling^*, Biswajit Bhattacharya^*

^*Corresponding author for this work

Chemistry

Research output: Contribution to journal › Article › peer-review

14 Downloads (Pure)

Abstract

Mechanical flexibility in molecular crystals is a fascinating behavior with potential for developing advanced technologies. However, the phenomenon of mechanical bending is poorly understood. We explore for the first time the atomistic origin of elastic bending in a single component organic crystal using a combination of μ-focus synchrotron X-ray diffraction and ab initio simulation.

Original language	English
Pages (from-to)	6244-6249
Number of pages	6
Journal	Crystal Growth and Design
Volume	23
Issue number	9
Early online date	3 Aug 2023
DOIs	https://doi.org/10.1021/acs.cgd.3c00473
Publication status	E-pub ahead of print - 3 Aug 2023

Access to Document

10.1021/acs.cgd.3c00473Licence: Creative Commons: Attribution (CC BY)

FeilerT2023MechanisticFinal published version, 4.69 MBLicence: Creative Commons: Attribution (CC BY)

Cite this

@article{02ef344a03f1428f999b4e822a07b5b6,

title = "Mechanistic Investigation of an Elastically Flexible Organic Crystal",

abstract = "Mechanical flexibility in molecular crystals is a fascinating behavior with potential for developing advanced technologies. However, the phenomenon of mechanical bending is poorly understood. We explore for the first time the atomistic origin of elastic bending in a single component organic crystal using a combination of μ-focus synchrotron X-ray diffraction and ab initio simulation.",

author = "Torvid Feiler and Nobuhiro Yasuda and Michalchuk, {Adam A. L.} and Franziska Emmerling and Biswajit Bhattacharya",

year = "2023",

month = aug,

day = "3",

doi = "10.1021/acs.cgd.3c00473",

language = "English",

volume = "23",

pages = "6244--6249",

journal = "Crystal Growth and Design",

issn = "1528-7483",

publisher = "American Chemical Society",

number = "9",

}

TY - JOUR

T1 - Mechanistic Investigation of an Elastically Flexible Organic Crystal

AU - Feiler, Torvid

AU - Yasuda, Nobuhiro

AU - Michalchuk, Adam A. L.

AU - Emmerling, Franziska

AU - Bhattacharya, Biswajit

PY - 2023/8/3

Y1 - 2023/8/3

N2 - Mechanical flexibility in molecular crystals is a fascinating behavior with potential for developing advanced technologies. However, the phenomenon of mechanical bending is poorly understood. We explore for the first time the atomistic origin of elastic bending in a single component organic crystal using a combination of μ-focus synchrotron X-ray diffraction and ab initio simulation.

AB - Mechanical flexibility in molecular crystals is a fascinating behavior with potential for developing advanced technologies. However, the phenomenon of mechanical bending is poorly understood. We explore for the first time the atomistic origin of elastic bending in a single component organic crystal using a combination of μ-focus synchrotron X-ray diffraction and ab initio simulation.

U2 - 10.1021/acs.cgd.3c00473

DO - 10.1021/acs.cgd.3c00473

M3 - Article

SN - 1528-7483

VL - 23

SP - 6244

EP - 6249

JO - Crystal Growth and Design

JF - Crystal Growth and Design

IS - 9

ER -

Mechanistic Investigation of an Elastically Flexible Organic Crystal

Abstract

Access to Document

Fingerprint

Cite this