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Titolo:
Ab initio molecular orbital studies of the positive muon and muonium in 4-arylmethyleneamino-TEMPO derivatives
Autore:
Briere, TM; Jeong, J; Das, TP; Ohira, S; Nagamine, K;
Indirizzi:
KEK, Inst Mat Struct Sci, Meson Sci Lab, Tsukuba, Ibaraki 3050801, Japan KEK Tsukuba Ibaraki Japan 3050801 ci Lab, Tsukuba, Ibaraki 3050801, Japan SUNY Albany, Dept Phys, Albany, NY 12222 USA SUNY Albany Albany NY USA 12222 Y Albany, Dept Phys, Albany, NY 12222 USA RIKEN, Muon Sci Lab, Wako, Saitama 3510198, Japan RIKEN Wako Saitama Japan 3510198 on Sci Lab, Wako, Saitama 3510198, Japan Univ Tokyo, Grad Sch Sci, Dept Phys, Bunkyo Ku, Tokyo 1138654, Japan Univ Tokyo Tokyo Japan 1138654 ept Phys, Bunkyo Ku, Tokyo 1138654, Japan
Titolo Testata:
PHYSICA B
, volume: 289, anno: 2000,
pagine: 128 - 131
SICI:
0921-4526(200008)289:<128:AIMOSO>2.0.ZU;2-W
Fonte:
ISI
Lingua:
ENG
Soggetto:
GAUSSIAN-TYPE BASIS; ORGANIC-MOLECULES;
Keywords:
4-arylmethyleneamino-2,2,6,6-tetramethylpiperidin-1-yloxyl radical; TEMPO; organic ferromagnet;
Tipo documento:
Article
Natura:
Periodico
Settore Disciplinare:
Physical, Chemical & Earth Sciences
Citazioni:
13
Recensione:
Indirizzi per estratti:
Indirizzo: Briere, TM KEK, Inst Mat Struct Sci, Meson Sci Lab, Tsukuba, Ibaraki 3050801, Japan KEK Tsukuba Ibaraki Japan 3050801 kuba, Ibaraki 3050801, Japan
Citazione:
T.M. Briere et al., "Ab initio molecular orbital studies of the positive muon and muonium in 4-arylmethyleneamino-TEMPO derivatives", PHYSICA B, 289, 2000, pp. 128-131

Abstract

The muon and muonium bonding sites of the 4-arylmethyleneamino-2,2,6,6-tetramethylpiperidin-1-yloxyl radical crystals with aryl groups consisting of biphenyl and 4-pyridyl were studied via ab initio Hartree-Fock theory. The hyperfine fields, including both intramolecular and intermolecular interactions, were calculated at the sites of interest and compared to zero field mu SR results. (C) 2000 Elsevier Science B.V. All rights reserved.

ASDD Area Sistemi Dipartimentali e Documentali, Università di Bologna, Catalogo delle riviste ed altri periodici
Documento generato il 29/03/20 alle ore 15:01:36