검색결과 : 15건
| No. | Article |
|---|---|
| 1 |
[Co/Fe(alpha-Alkyl-tpdt)(2)](x-): Alkyl-Substituted Cobalt and Iron Bis-dithiolenethiophenic Complexes Silva RAL, Santos R, Andrade MM, Santos IC, Coutinho JT, Pereira LCJ, Waerenborgh JC, Vieira BJC, Cirera J, Ruiz E, Almeida M, Belo D Inorganic Chemistry, 59(13), 9261, 2020 |
| 2 |
Electronic and Steric Control of the Spin-Crossover Behavior in [(Cp-R)(2)Mn] Manganocenes Cirera J, Ruiz E Inorganic Chemistry, 57(2), 702, 2018 |
| 3 |
Benchmarking Density Functional Methods for Calculation of State Energies of First Row Spin-Crossover Molecules Cirera J, Via-Nadal M, Ruiz E Inorganic Chemistry, 57(22), 14097, 2018 |
| 4 |
Theoretical Modeling of the Ligand-Tuning Effect over the Transition Temperature in Four-Coordinated Fe-II Molecules Cirera J, Ruiz E Inorganic Chemistry, 55(4), 1657, 2016 |
| 5 |
Non-Switching 1,2-Dithienylethene-based Diplatinum(II) Complex Showing High Cytotoxicity Presa A, Barrios L, Cirera J, Korrodi-Gregorio L, Perez-Tomas R, Teat SJ, Gamez P Inorganic Chemistry, 55(11), 5356, 2016 |
| 6 |
Molecular Mechanisms of Spin Crossover in the {Fe(pz)[Pt(CN)(4)]} Metal-Organic Framework upon Water Adsorption Pham CH, Cirera J, Paesani F Journal of the American Chemical Society, 138(19), 6123, 2016 |
| 7 |
Structure of the Reduced Copper Active Site in Preprocessed Galactose Oxidase: Ligand Tuning for One-Electron O-2 Activation in Cofactor Biogenesis Cowley RE, Cirera J, Qayyum MF, Rokhsana D, Hedman B, Hodgson KO, Dooley DM, Solomon EI Journal of the American Chemical Society, 138(40), 13219, 2016 |
| 8 |
Copper Active Sites in Biology Solomon EI, Heppner DE, Johnston EM, Ginsbach JW, Cirera J, Qayyum M, Kieber-Emmons MT, Kjaergaard CH, Hadt RG, Tian L Chemical Reviews, 114(7), 3659, 2014 |
| 9 |
Theoretical Modeling of Spin Crossover in Metal-Organic Frameworks: [Fe(pz)(2)Pt(CN)(4)] as a Case Study Cirera J, Babin V, Paesani F Inorganic Chemistry, 53(20), 11020, 2014 |
| 10 |
Theoretical Prediction of Spin-Crossover Temperatures in Ligand-Driven Light-Induced Spin Change Systems Cirera J, Paesani F Inorganic Chemistry, 51(15), 8194, 2012 |