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          Document History for Document ID 633330

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Document Version Version Comment Date Status
633330.0 [No comment] 17.05.2016 11:01 Released

ID: 633330.0, MPI für bioanorganische Chemie / MPI für bioanorganische Chemie
Metal-to-metal charge-transfer transitions: reliable excitation energies from ab initio calculations
Authors:Domingo, Alex; Carvajal, Maria A.; de Graaf, Coen; Sivalingam, Kantharuban; Neese, Frank; Angeli, Celestino
Language:English
Date of Publication (YYYY-MM-DD):2012-06-13
Title of Journal:Theoretical Chemistry Accounts
Journal Abbrev.:Theor. Chem. Acc.
Volume:131
Issue / Number:9
Start Page:1264
End Page:1276
Review Status:Peer-review
Audience:Experts Only
Free Keywords:Metal-to-metal charge transfer; Photomagnetism; CASPT2; NEVPT2; TD-DFT
External Publication Status:published
Document Type:Article
Communicated by:N. N.
Affiliations:MPI für bioanorganische Chemie
External Affiliations:[Domingo, A.; Carvajal, M.A.; de Graaf, C.] Univ Rovira & Virgili, Dept Quim Fis & Inorgan, Tarragona 43007, Spain.
[Domingo, A.] Univ Strasbourg, Lab Chim Quant, Inst Chim, UMR 7177, F-67000 Strasbourg, France.
[de Graaf, C.] ICREA, Barcelona 08010, Spain.
[Celestino, A.] Univ Ferrara, Dipartimento Chim, I-44121 Ferrara, Italy.
Identifiers:ISI:000309338200002 [ID No:1]
ISSN:1432-881X [ID No:2]
DOI:10.1007/s00214-012-1264-1 [ID No:3]