Helical Molecular Springs with Varying Spring Constants.

Murphy, Kyle E; McKay, Kyle T; Schenkelberg, Mica; Sharafi, Mona; Vestrheim, Olav; Ivancic, Monika; Li, Jianing; Schneebeli, Severin T

Murphy, Kyle E; McKay, Kyle T; Schenkelberg, Mica; Sharafi, Mona; Vestrheim, Olav; Ivancic, Monika; Li, Jianing; Schneebeli, Severin T.

Afiliación

Murphy KE; Department of Chemistry, University of Vermont, 82 University Place, Burlington, VT 05405, USA.
McKay KT; Department of Chemistry, University of Vermont, 82 University Place, Burlington, VT 05405, USA.
Schenkelberg M; Departments of Industrial & Physical Pharmacy, Chemistry, and Medicinal Chemistry & Molecular Pharmacology, Purdue University, 575 Stadium Mall Drive, West Lafayette, IN 47907, USA.
Sharafi M; Department of Chemistry, University of Vermont, 82 University Place, Burlington, VT 05405, USA.
Vestrheim O; Departments of Industrial & Physical Pharmacy, Chemistry, and Medicinal Chemistry & Molecular Pharmacology, Purdue University, 575 Stadium Mall Drive, West Lafayette, IN 47907, USA.
Ivancic M; Department of Chemistry, University of Vermont, 82 University Place, Burlington, VT 05405, USA.
Li J; Departments of Industrial & Physical Pharmacy, Chemistry, and Medicinal Chemistry & Molecular Pharmacology, Purdue University, 575 Stadium Mall Drive, West Lafayette, IN 47907, USA.
Schneebeli ST; Departments of Industrial & Physical Pharmacy, Chemistry, and Medicinal Chemistry & Molecular Pharmacology, Purdue University, 575 Stadium Mall Drive, West Lafayette, IN 47907, USA.

Angew Chem Int Ed Engl ; 61(50): e202209772, 2022 12 12.

Article en En | MEDLINE | ID: mdl-36161747

Asunto(s)

Simulación de Dinámica Molecular; Polímeros; Polímeros/química

Palabras clave

Exciton Coupling; Hookean Molecular Springs; Model-Free Analysis; Single-Handed Ladder Polymers; Time-Dependent Density Functional Theory

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Texto completo: 1 Colección: 01-internacional Base de datos: MEDLINE Asunto principal: Polímeros / Simulación de Dinámica Molecular Idioma: En Revista: Angew Chem Int Ed Engl Año: 2022 Tipo del documento: Article País de afiliación: Estados Unidos Pais de publicación: Alemania

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