Polymorphs and colors of polydiacetylenes: A first principles study

Journal of the American Chemical Society

Volumn 131, Issue 20, 2009, Pages 6976-6988

  Filhol, Jean Sébastien ^a   Deschamps, Jérôme ^a   Dutremez, Sylvain G ^a   Boury, Bruno ^a   Barisien, Thierry ^b   Legrand, Laurent ^b   Schott, Michel ^b  

^a UNIVERSITÉ DE MONTPELLIER   (France)

^b INSTITUT DES NANOSCIENCES DE PARIS   (France)

Author keywords

[No Author keywords available]

Indexed keywords

CONDENSED MATTER; CONJUGATED BACKBONES; ENERGETIC COSTS; EXTERNAL STIMULUS; FIRST-PRINCIPLES; FIRST-PRINCIPLES STUDY; NMR SPECTRUM; POLYDIACETYLENES; POLYMERIC MATERIAL; PROPERTY CHANGES;

ACETYLENE; ELECTRONIC STRUCTURE; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY; PERSONAL DIGITAL ASSISTANTS;

ISOMERS;

ACETYLENE DERIVATIVE; POLYMER; POLYACETYLENE DERIVATIVE; POLYDIACETYLENE;

ARTICLE; CHEMICAL STRUCTURE; CONFORMATION; ELECTRONICS; ISOMERISM; NANOTECHNOLOGY; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY; RAMAN SPECTROMETRY; CHEMICAL MODEL; CHEMISTRY; CRYSTALLIZATION; THERMODYNAMICS;

CRYSTALLIZATION; MAGNETIC RESONANCE SPECTROSCOPY; MODELS, CHEMICAL; MODELS, MOLECULAR; MOLECULAR CONFORMATION; POLYACETYLENES; POLYMERS; SPECTRUM ANALYSIS, RAMAN; THERMODYNAMICS;

EID: 70349089767     PISSN: 00027863     EISSN: None     Source Type: Journal    
DOI: 10.1021/ja803768u     Document Type: Article

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