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Neerlandica Wratislaviensia--Acta Universitatis Wratislaviensis, ISSN 0860-0716, 2012, Volume 21, p. 127
Journal Article
2017, Religious ethics and environmental challenges, ISBN 149854245X, xxviii, 261 pages
Book
2005, ISBN 9780754650645
Book
Inorganica Chimica Acta, ISSN 0020-1693, 02/2019, Volume 486, pp. 26 - 35
The reduction of a polypyridine ligand is more than 0.5 V more negative than the reduction of the coordinated ligand in polypyridine-Co(I) complex. [Display... 
Reduction potential | DFT | Polypyridine ligands | Cobalt | SPIN-CROSSOVER | COBALT(II) | STATE | POTENTIALS | CHEMISTRY, INORGANIC & NUCLEAR | REDUCTION | REDOX | MEDIATORS | DENSITY-FUNCTIONAL THEORY | TERPYRIDINE COMPLEXES | Substitutes | Rigid structures | Organic chemistry | Reduction | Ligands | Jahn-Teller effect | Elongation
Journal Article
2015, Studies in religion and the environment, ISBN 9783643906250, Volume 10, viii, 350 pages.
Book
2014, ISBN 9780567567659, vi, 261
Christianity has often been accused for being complicit in ecological destruction. In response, Christian ecotheology offers both a Christian critique of... 
Ecotheology | Christianity | Human ecology | Religious aspects
Book
Inorganica Chimica Acta, ISSN 0020-1693, 02/2019, Volume 486, pp. 193 - 199
A higher concentration of electron density between the metal and the two ligands on the z-axis, than between the metal and the four ligands on the xy-plane,... 
Jahn-Teller effect | Elongation | DFT calculations | Distortion | Molecular orbitals | Ligands | Coordination compounds | Electron density | Electrons
Journal Article
Dalton Transactions, ISSN 1477-9226, 12/2014, Volume 44, Issue 4, pp. 1503 - 1515
Density functional theory (DFT) results on the geometry, energies and charges of selected Rh- beta -diketonato reactants, products and transition states are... 
Energy use | Mathematical analysis | Electronics | Grounds | Density functional theory | Ligands | Orientation | Isomers
Journal Article
Dalton Transactions, ISSN 1477-9226, 01/2015, Volume 44, Issue 4, pp. 1503 - 1515
Density functional theory (DFT) results on the geometry, energies and charges of selected Rh-beta-diketonato reactants, products and transition states are... 
SQUARE-PLANAR | ORDER REGULAR APPROXIMATION | EFFECTIVE CORE POTENTIALS | MOLECULAR-STRUCTURE | CRYSTAL-STRUCTURE | X-RAY | CONFORMATIONAL-ANALYSIS | IODIDE OXIDATIVE ADDITION | SOLID-STATE PACKING | METHYL-IODIDE | CHEMISTRY, INORGANIC & NUCLEAR
Journal Article
FRONTIERS IN PHYSIOLOGY, ISSN 1664-042X, 12/2018, Volume 9, p. 1812
It is known that advanced metabolic disorders such as type 2 diabetes compromise the functional and regenerative capacity of endogenous adipose-tissue resident... 
PHYSIOLOGY | DEPOTS | MOBILIZATION | BONE-MARROW | adipose tissue | PROLIFERATION | osteogenesis | FACTOR-I | HEMATOPOIETIC PROGENITOR | IL-6 | interleukin 6 | body composition | adipogenesis | mesenchymal stem cells | cytokines | DIFFERENTIATION | DYSFUNCTION | obesity | Adipose tissues | Metabolic diseases | Development and progression | Research | Stem cells
Journal Article
Journal of Organometallic Chemistry, ISSN 0022-328X, 03/2017, Volume 833, pp. 88 - 94
A computational chemistry study using DFT explains why the electrical conductivity along the metal axis in adjacent [Rh(acetylacetonato)(CO)2] molecules was... 
MOs | NBO | Metal-metal bonds | QTAIM | DENSITY | HYDROGEN | CRYSTAL-STRUCTURE | CHEMISTRY, ORGANIC | BOND | INTERMOLECULAR INTERACTIONS | GREEN SALT | CHEMISTRY, INORGANIC & NUCLEAR | Comparative analysis | Electrical conductivity | Bonds
Journal Article
Journal Article
Electrochimica Acta, ISSN 0013-4686, 01/2015, Volume 152, pp. 512 - 519
Journal Article
Computational and Theoretical Chemistry, ISSN 2210-271X, 02/2017, Volume 1101, pp. 30 - 35
DFT study of the stacking [Rh(acac)(CO)2] molecules along the rhodium-rhodium axis. [Display omitted] •QTAIM calculations indicate RhRh bond paths in adjacent... 
Metal-metal interaction | NBO | DFT | Rhodium | QTAIM | CATALYSIS | HYDROGENATION | EFFECTIVE CORE POTENTIALS | CRYSTAL-STRUCTURE | COMPLEXES | CHEMISTRY, PHYSICAL | SOLID-STATE | DENSITY | CHEMISTRY | HYDROFORMYLATION | Hydrogen | Hydrogen bonding | Bonds
Journal Article
Inorganica Chimica Acta, ISSN 0020-1693, 02/2019, Volume 486, p. 193
The Jahn-Teller effect, which is the geometrical effect on a molecule due to the energy lowering of spatially degenerate electronic ground states, is not... 
Journal Article
Polyhedron, ISSN 0277-5387, 02/2017, Volume 123, pp. 252 - 258
A DFT study of cis and trans oxidative addition to [Ir(acac)(cod)] shows that oxidative addition of CH3I to [Ir(acac)(cod)] occurs via a trans transition... 
Oxidative addition | DFT | Cis/trans addition | Iridium | Transition state | METHANOL CARBONYLATION | MOLECULAR-STRUCTURE | REACTION-PRODUCTS | RHODIUM(I) COMPLEXES | CRYSTALLOGRAPHY | ACETIC-ACID | CATALYTIC CARBONYLATION | CATIVA(TM) PROCESS | CHEMISTRY, INORGANIC & NUCLEAR | SCREENING MODEL | METHYL-IODIDE | LOW-PRESSURE | Thermodynamics | Analysis | Investigations | Quantum theory
Journal Article