Supplementary information for: "Origin of the Zero-Field Splitting in Mononuclear Octahedral Mn-IV Complexes: A Combined Experimental and Theoretical Investigation"
Authors
Zlatar, MatijaGruden, Maja
Vassilyeva, Olga Yu
Buvaylo, Elena A.
Ponomarev, A. N.
Zvyagin, S. A.
Wosnitza, J.
Krzystek, J.
Garcia-Fernandez, Pablo
Duboc, Carole
Dataset (Published version)
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Additional EPR spectra and computational details. Cartesian coordinates of all structures reoriented in a standard way, as explained in the main text.
Source:
Inorganic Chemistry, 2016Publisher:
- American Chemical Society (ACS)
Funding / projects:
- Rational design and synthesis of biologically active and coordination compounds and functional materials, relevant for (bio)nanotechnology (RS-172035)
- COST Action ECOSTBio (Explicit Control Over Spin-States in Technology and Biochemistry) including a STSM grant [CM1305, COST-STSM-CM1305-25068]
- HLD at HZDR, member of the European Magnetic Field Laboratory (EMFL)
- French National Agency for Research [ANR-09-JCJC-0087]
- US Department of Energy
- State of Florida
- NSF [DMR 1157490]
- Ramon and Cajal fellowship [RYC-2013-12515]
- IR-RPE CNRS [3443]
- Deutsche Forschungsgemeinschaft (DFG, Germany)
- HLD
- Labex arcane [ANR-11-LABX-003]
Note:
- This is the supporting information for the article: Zlatar, M., Gruden, M., Vassilyeva, O. Y., Buvaylo, E. A., Ponomarev, A. N., Zvyagin, S. A., Wosnitza, J., Krzystek, J., Garcia-Fernandez, P.,& Duboc, C. (2016). Origin of the Zero-Field Splitting in Mononuclear Octahedral Mn-IV Complexes: A Combined Experimental and Theoretical Investigation. Inorganic Chemistry, American Chemical Society (ACS)., 55(3), 1192-1201. https://doi.org/10.1021/acs.inorgchem.5b02368
- The published version of the article: https://cer.ihtm.bg.ac.rs/handle/123456789/1955
Related info:
- Referenced by
https://doi.org/10.1021/acs.inorgchem.5b02368 - Referenced by
https://cer.ihtm.bg.ac.rs/handle/123456789/1955
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IHTMTY - DATA AU - Zlatar, Matija AU - Gruden, Maja AU - Vassilyeva, Olga Yu AU - Buvaylo, Elena A. AU - Ponomarev, A. N. AU - Zvyagin, S. A. AU - Wosnitza, J. AU - Krzystek, J. AU - Garcia-Fernandez, Pablo AU - Duboc, Carole PY - 2016 UR - https://cer.ihtm.bg.ac.rs/handle/123456789/4465 AB - Additional EPR spectra and computational details. Cartesian coordinates of all structures reoriented in a standard way, as explained in the main text. PB - American Chemical Society (ACS) T2 - Inorganic Chemistry T1 - Supplementary information for: "Origin of the Zero-Field Splitting in Mononuclear Octahedral Mn-IV Complexes: A Combined Experimental and Theoretical Investigation" DO - 10.1021/acs.inorgchem.5b02368.s001 ER -
@misc{ author = "Zlatar, Matija and Gruden, Maja and Vassilyeva, Olga Yu and Buvaylo, Elena A. and Ponomarev, A. N. and Zvyagin, S. A. and Wosnitza, J. and Krzystek, J. and Garcia-Fernandez, Pablo and Duboc, Carole", year = "2016", abstract = "Additional EPR spectra and computational details. Cartesian coordinates of all structures reoriented in a standard way, as explained in the main text.", publisher = "American Chemical Society (ACS)", journal = "Inorganic Chemistry", title = "Supplementary information for: "Origin of the Zero-Field Splitting in Mononuclear Octahedral Mn-IV Complexes: A Combined Experimental and Theoretical Investigation"", doi = "10.1021/acs.inorgchem.5b02368.s001" }
Zlatar, M., Gruden, M., Vassilyeva, O. Y., Buvaylo, E. A., Ponomarev, A. N., Zvyagin, S. A., Wosnitza, J., Krzystek, J., Garcia-Fernandez, P.,& Duboc, C.. (2016). Supplementary information for: "Origin of the Zero-Field Splitting in Mononuclear Octahedral Mn-IV Complexes: A Combined Experimental and Theoretical Investigation". in Inorganic Chemistry American Chemical Society (ACS).. https://doi.org/10.1021/acs.inorgchem.5b02368.s001
Zlatar M, Gruden M, Vassilyeva OY, Buvaylo EA, Ponomarev AN, Zvyagin SA, Wosnitza J, Krzystek J, Garcia-Fernandez P, Duboc C. Supplementary information for: "Origin of the Zero-Field Splitting in Mononuclear Octahedral Mn-IV Complexes: A Combined Experimental and Theoretical Investigation". in Inorganic Chemistry. 2016;. doi:10.1021/acs.inorgchem.5b02368.s001 .
Zlatar, Matija, Gruden, Maja, Vassilyeva, Olga Yu, Buvaylo, Elena A., Ponomarev, A. N., Zvyagin, S. A., Wosnitza, J., Krzystek, J., Garcia-Fernandez, Pablo, Duboc, Carole, "Supplementary information for: "Origin of the Zero-Field Splitting in Mononuclear Octahedral Mn-IV Complexes: A Combined Experimental and Theoretical Investigation"" in Inorganic Chemistry (2016), https://doi.org/10.1021/acs.inorgchem.5b02368.s001 . .