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Towards accurate estimates of the spin-state energetics of spin-crossover complexes within density functional theory: a comparative case study of cobalt(ii) complexesPCCP. Physical chemistry chemical physics
accessLevelRestricted
2013 651 0
Characterization of spin-crossover and related transition metal complexes within density functional theory
accessLevelPublic
2009 886 1,302
What governs nitrogen configuration in substituted aminophosphines?Journal of physical organic chemistry
accessLevelPublic
2009 678 412
Influence of Guest−Host Interactions on the Structural, Energetic, and Mössbauer Spectroscopy Properties of Iron(II)tris(2,2'-bipyridine) in the Low-Spin and High-Spin States: A Density-Functional Theory Study of the Zeolite-Y Embedded ComplexJournal of chemical theory and computation
accessLevelPublic
2009 784 568
Spin-crossover in cobalt(II) imine complexesCoordination chemistry reviews
accessLevelPublic
2007 850 1,093
Low-temperature lifetimes of metastable high-spin states in spin-crossover and in low-spin iron(II) compounds: The rule and exceptions to the ruleCoordination chemistry reviews
accessLevelPublic
2006 683 899
Density-functional theory investigation of the geometric, energetic and optical properties of the cobalt(II)tris(2,2'-bipyridine) complex in the high-spin and in the Jahn-Teller active low-spin stateJournal of chemical theory and computation
accessLevelPublic
2006 659 429
Assessment of Density Functionals for the High-Spin/Low-Spin Energy Difference in the Low-Spin Iron(II) Tris(2,2'-bipyridine) ComplexChemPhysChem
accessLevelPublic
2005 805 810
Effect of single point mutations of the human tachykinin NK1 receptor on antagonist affinityEuropean journal of pharmacology
1997 464 0
Functional Activity of a Biotinylated Human Neurokinin 1 Receptor Fusion Expressed in the Semliki Forest Virus SystemBiochemical and biophysical research communications
1995 601 0
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