scholarly journals Heteroleptic Iron(III) Spin Crossover Complexes; Ligand Substitution Effects

2016 ◽  
Vol 2 (1) ◽  
pp. 3 ◽  
Author(s):  
Wasinee Phonsri ◽  
David Macedo ◽  
Boujemaa Moubaraki ◽  
John Cashion ◽  
Keith Murray
Keyword(s):  
Spin Crossover ◽  
Ligand Substitution ◽  
Substitution Effects ◽  
Spin Crossover Complexes

scholarly journals Halogen Substitution Effects on N2 O Schiff Base Ligands in Unprecedented Abrupt FeII Spin Crossover Complexes

2017 ◽  
Vol 23 (29) ◽  
pp. 7052-7065 ◽  
Author(s):  
Wasinee Phonsri ◽  
David S. Macedo ◽  
Kuduva R. Vignesh ◽  
Gopalan Rajaraman ◽  
Casey G. Davies ◽  
...  
Keyword(s):  
Schiff Base ◽  
Spin Crossover ◽  
Substitution Effects ◽  
Schiff Base Ligands ◽  
Spin Crossover Complexes

scholarly journals Ligand substitution effects on the charge transport properties of the spin crossover complex [Fe(Htrz)1+y−x (trz)2−y (NH2trz) x ](BF4)y·nH2O

2020 ◽  
Vol 32 (26) ◽  
pp. 264002
Author(s):  
Ion Soroceanu ◽  
Simona-Lacramioara Lupu ◽  
Ionela Rusu ◽  
Mario Piedrahita-Bello ◽  
Lionel Salmon ◽  
...  
Keyword(s):  
Charge Transport ◽  
Transport Properties ◽  
Spin Crossover ◽  
Ligand Substitution ◽  
Substitution Effects

A New Family of Anionic FeIII Spin Crossover Complexes Featuring a Weak-Field N2 O4 Coordination Octahedron

2015 ◽  
Vol 22 (4) ◽  
pp. 1253-1257 ◽  
Author(s):  
Kazuyuki Takahashi ◽  
Kiko Kawamukai ◽  
Mitsunobu Okai ◽  
Tomoyuki Mochida ◽  
Takahiro Sakurai ◽  
...  
Keyword(s):  
Spin Crossover ◽  
Weak Field ◽  
New Family ◽  
Spin Crossover Complexes

Relevance of supramolecular interactions, texture and lattice occupancy in the designer iron(II) spin crossover complexes

2009 ◽  
Vol 182 (6) ◽  
pp. 1365-1376 ◽  
Author(s):  
Anil D. Naik ◽  
Bernard Tinant ◽  
Kai Muffler ◽  
Juliusz A. Wolny ◽  
Volker Schünemann ◽  
...  
Keyword(s):  
Spin Crossover ◽  
Supramolecular Interactions ◽  
Spin Crossover Complexes

Asymmetric Design of Spin-Crossover Complexes to Increase the Volatility for Surface Deposition

2021 ◽  
Author(s):  
Miguel Gakiya-Teruya ◽  
Xuanyuan Jiang ◽  
Duy Le ◽  
Ökten Üngör ◽  
Abdullah J. Durrani ◽  
...  
Keyword(s):  
Spin Crossover ◽  
Surface Deposition ◽  
Spin Crossover Complexes

Targeted structural modification of spin crossover complexes: pyridine vs pyrazine

2017 ◽  
Vol 30 (4) ◽  
pp. 296-304 ◽  
Author(s):  
Humphrey L. C. Feltham ◽  
Matthew G. Cowan ◽  
Jonathan A. Kitchen ◽  
Guy N. L. Jameson ◽  
Sally Brooker
Keyword(s):  
Structural Modification ◽  
Spin Crossover ◽  
Spin Crossover Complexes

scholarly journals CASPT2 molecular geometries of Fe(II) spin-crossover complexes

2021 ◽  
Author(s):  
Brian A. Finney ◽  
Sabyasachi Roy Chowdhury ◽  
Clara Kirkvold ◽  
Bess Vlaisavljevich
Keyword(s):  
Spin Crossover ◽  
Spin Crossover Complexes ◽  
Analytical Gradients

Using fully internally contracted (FIC)-CASPT2 analytical gradients, geometry optimizations of spin-crossover complexes are reported. This approach is tested on a series of Fe(II) complexes with different sizes, ranging from 13...

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