Computational discovery of transition-metal complexes: from high-throughput screening to machine learning
Transition-metal complexes are attractive targets for the design of catalysts and functional
materials. The behavior of the metal–organic bond, while very tunable for achieving target …
materials. The behavior of the metal–organic bond, while very tunable for achieving target …
OctaDist: a tool for calculating distortion parameters in spin crossover and coordination complexes
OctaDist is an interactive and visual program for determination of structural distortion in
octahedral coordination complexes such as spin crossover complexes, single-ion magnets …
octahedral coordination complexes such as spin crossover complexes, single-ion magnets …
Understanding of cooperative effects in molecule-based spin transition materials
Y Fang, YS Meng, H Oshio, T Liu - Coordination Chemistry Reviews, 2024 - Elsevier
Spin transition (ST) materials, exhibiting spin state conversions by external stimuli, have
been studied for over a half-century and have been continuing research interests owing to …
been studied for over a half-century and have been continuing research interests owing to …
Octacyanidorhenate (V) ion as an efficient linker for hysteretic two‐step iron (II) spin crossover switchable by temperature, light, and pressure
S Chorazy, T Charytanowicz… - Angewandte Chemie …, 2020 - Wiley Online Library
A two‐step hysteretic FeII spin crossover (SCO) effect was achieved in programmed layered
Cs {[Fe (3‐CNpy) 2][Re (CN) 8]}⋅ H2O (1)(3‐CNpy= 3‐cyanopyridine) assembly consisting …
Cs {[Fe (3‐CNpy) 2][Re (CN) 8]}⋅ H2O (1)(3‐CNpy= 3‐cyanopyridine) assembly consisting …
Increasing spin crossover cooperativity in 2D Hofmann-type materials with guest molecule removal
Molecule-based spin state switching materials that display ambient temperature transitions
with accompanying wide thermal hysteresis offer an opportunity for electronic switching …
with accompanying wide thermal hysteresis offer an opportunity for electronic switching …
The First Observation of Hidden Hysteresis in an Iron (III) Spin‐Crossover Complex
Molecular magnetic switches are expected to form the functional components of future
nanodevices. Herein we combine detailed (photo‐) crystallography and magnetic studies to …
nanodevices. Herein we combine detailed (photo‐) crystallography and magnetic studies to …
Reversible on–off switching of the hysteretic spin crossover in a cobalt (II) complex via crystal to crystal transformation
Reversible controlling and switching of magnetic bistability remains relatively difficult. Here,
reversible on–off switching of a hysteretic spin transition in a CoII complex via a single …
reversible on–off switching of a hysteretic spin transition in a CoII complex via a single …
Fluorescence modulation via photoinduced spin crossover switched energy transfer from fluorophores to Fe II ions
Molecular materials possessing phototunable fluorescence properties have attracted great
interest owing to their potential applications in optical switches and storage. However, most …
interest owing to their potential applications in optical switches and storage. However, most …
Valence tautomerism and spin crossover in pyridinophane–cobalt–dioxolene complexes: an experimental and computational study
T Tezgerevska, E Rousset, RW Gable… - Dalton …, 2019 - pubs.rsc.org
Compounds [Co (L-N4R2)(dbdiox)](BPh4)(L-N4R2= N, N′-di-alkyl-2, 11-diaza [3.3]-(2, 6)
pyridinophane, R= iPr (1a), Et (2a); dbdiox= 3, 5-di-tert-butyldioxolene) and [M (L …
pyridinophane, R= iPr (1a), Et (2a); dbdiox= 3, 5-di-tert-butyldioxolene) and [M (L …
Stimuli-responsive magnetic materials: impact of spin and electronic modulation
Addressing molecular bistability as a function of external stimuli, especially in spin-crossover
(SCO) and metal-to-metal electron transfer (MMET) systems, has seen a surge of interest in …
(SCO) and metal-to-metal electron transfer (MMET) systems, has seen a surge of interest in …