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Akademický článek

Understanding melting of Ti crystals with spherical voids from molecular dynamics simulations.

Autor: Hazarika, Manash Protim¹ (AUTHOR), Chakraborty, Somendra Nath¹ (AUTHOR) snchakraborty@cus.ac.in

Publikováno v: Journal of Applied Physics. 2/21/2024, Vol. 135 Issue 7, p1-9. 9p.

Akademický článek

Dynamic Luminescence Vapochromism of Pyridinium‐Based Organic Salts.

Autor: Sääsk, Verner¹ (AUTHOR) verner@saask.ee, Abe, Ayano² (AUTHOR), Kametani, Yohei¹ (AUTHOR), Shiota, Yoshihito¹ (AUTHOR), Sato, Osamu¹ (AUTHOR), Adachi, Chihaya² (AUTHOR)

Publikováno v: Chemistry - A European Journal. Sep2024, p1. 8p. 7 Illustrations.

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Akademický článek

A novel one‐dimensional thiocyanate‐bridged cobalt(III) complex: synthesis, crystal structure characterization and Hirshfeld surface analysis.

Autor: Mandal, Uttam¹ (AUTHOR), Rizzoli, Corrado² (AUTHOR), Chakraborty, Bikash³ (AUTHOR), Bandyopadhyay, Debasis⁴ (AUTHOR), Mandal, Santanu⁴ (AUTHOR) santanubcc@rediffmail.com

Publikováno v: Acta Crystallographica Section C: Structural Chemistry. Aug2024, Vol. 80 Issue 8, p394-400. 7p.

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Akademický článek

Smartphone‐Based Molecularly Imprinted Photonic Crystal Hydrogel Sensor for the Label‐Free Detection of Bisphenol A.

Autor: Sree Sanker, S. S.¹ (AUTHOR) sreesanker@cusat.ac.in, Thomas, Subin² (AUTHOR), Nalini, Savitha³ (AUTHOR), Jacob, Dhanya P.⁴ (AUTHOR), Suniya, Vathiyedath Sulaiman¹ (AUTHOR), Madhusoodanan, Kottarathil Naduvil¹ (AUTHOR)

Publikováno v: Macromolecular Chemistry & Physics. Jul2024, Vol. 225 Issue 14, p1-10. 10p.

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Akademický článek

Crystal structure, Hirshfeld surface analysis, calculations of crystal voids, interaction energy and energy frameworks as well as density functional theory (DFT) calculations of 3-[2-(morpholin-4-yl)-ethyl]-5,5-diphenylimidazolidine-2,4-dione.

Autor: Lamssane, Houda¹ houda.lamssane@usmba.ac.ma, Haoudi, Amal¹, Kartah, Badr Eddine², Mazzah, Ahmed³, Mague, Joel T.⁴, Hökelek, Tuncer⁵, Rodi, Youssef Kandri¹, Sebbar, Nada Kheira^2,6

Publikováno v: Acta Crystallographica Section E: Crystallographic Communications. Mar2024, Vol. 80 Issue 4, p423-429. 13p.

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Akademický článek

Diversity of N‐triphenylacetyl‐l‐tyrosine solvates with halogenated solvents.

Autor: Czapik, Agnieszka¹ (AUTHOR) agnieszka.czapik@amu.edu.pl, Kwit, Marcin¹ (AUTHOR)

Publikováno v: Acta Crystallographica Section C: Structural Chemistry. Dec2021, Vol. 77 Issue 12, p745-756. 12p.

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Akademický článek

Crystal structure, Hirshfeld surface analysis, crystal voids, interaction energy calculations and energy frameworks and DFT calculations of ethyl 2-cyano-3-(3-hydroxy-5-methyl-1H-pyrazol-4-yl)-3-phenylpropanoate.

Autor: Elmachkouri, Younesse Ait¹ younesse.aitelmachkouri@edu.uiz.ac.ma, Irrou, Ezaddine¹, El Monfalouti, Hanae², Mazzah, Ahmed³, Hökelek, Tuncer⁴, Mague, Joel T.⁵, Taha, Mohamed Labd¹, Sebbar, Nada Kheira^1,2

Publikováno v: Acta Crystallographica Section E: Crystallographic Communications. Feb2024, Vol. 80 Issue 2, p240-246. 12p.

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Akademický článek

Crystal structure, Hirshfeld surface analysis, crystal voids, interaction energy calculations and energy frameworks, and DFT calculations of 1-(4-methylbenzyl)indoline-2,3-dione.

Autor: Rharmili, Nohaila¹ Nohaila.rharmili@usmba.ac.ma, Abdellaoui, Omar¹, Chahdi, Fouad Ouazzani¹, Mague, Joel T.², Hökelek, Tuncer³, Mazzah, Ahmed⁴, Rodi, Youssef Kandri¹, Sebbar, Nada Kheira^5,6

Publikováno v: Acta Crystallographica Section E: Crystallographic Communications. Feb2024, Vol. 80 Issue 2, p232-239. 13p.

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Akademický článek

Synthesis, single crystal X-ray structure determination, Hirshfeld surface analysis, crystal voids studies, and density functional theory calculations of N-carbamothioylbenzamide and 1,3,5-triazinane-2,4,6-trithione co-crystal.

Autor: Aziz, Hamid^1,2 (AUTHOR) hamidazizwazir@gmail.com, Saeed, Aamer¹ (AUTHOR), Simpson, Jim³ (AUTHOR), Shabir, Ghulam¹ (AUTHOR), Hökelek, Tuncer⁴ (AUTHOR), Khan, Ismat Ullah^1,5 (AUTHOR), Jabeen, Erum⁶ (AUTHOR)

Publikováno v: Structural Chemistry. Feb2024, Vol. 35 Issue 1, p305-319. 15p.

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Akademický článek

Synthesis, crystal structure and computational analysis of 2,7-bis(4-chlorophenyl)-3,3-dimethyl1,4-diazepan-5-one.

Autor: Akila, Shanmugasundaram¹, Vidhyasagar, Thankakan¹, Winfred Jebaraj, ohn Peter², Thiruvalluvar, Aravazhi Amalan³ thiruvalluvar.a@gmail.com, Rajeswari, Krishnan^1,4 rraajjii2006@gmail.com

Publikováno v: Acta Crystallographica Section E: Crystallographic Communications. Dec2023, Vol. 79 Issue 12, p1212-1217. 13p.

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