Molecular crystals under high pressure: Theoretical and experimental investigations of the solid-solid phase transitions in [Co2(CO) 6(XPh3)2] (X = P, As)

Chemistry - A European Journal

Volumn 15, Issue 17, 2009, Pages 4446-4457

  Casati, Nicola ^a   Macchi, Piero ^a,b   Sironi, Angelo ^a  

^a UNIVERSITY OF MILAN   (Italy)

^b UNIVERSITY OF BERN   (Switzerland)

Author keywords

Ab initio calculations; Conformation analysis; Metal metal interactions; Phase transitions; X ray diffraction

Indexed keywords

[CARBONYL; AB INITIO CALCULATIONS; AB-INITIO; ACCURATE ANALYSIS; AMBIENT CONDITIONS; CARBONYL LIGANDS; CONFORMATION ANALYSIS; CRYSTAL PHASE TRANSITIONS; EXPERIMENTAL INVESTIGATIONS; EXTERNAL STRESS; HIGH PRESSURES; INTERNAL ENERGIES; LOW-TEMPERATURE STRUCTURES; METAL-METAL BONDS; METAL-METAL INTERACTIONS; MOLECULAR SYMMETRIES; SOLID-SOLID PHASE TRANSITIONS; STRUCTURAL TRANSFORMATIONS; THEORETICAL CALCULATIONS; THEORETICAL MODELLING; THERMODYNAMIC QUANTITIES;

CARBONYLATION; CHEMICAL BONDS; COBALT; CONFORMATIONS; DIFFRACTION; LIGHT; METAL ANALYSIS; METALS; MOLECULAR CRYSTALS; X RAY DIFFRACTION; X RAY DIFFRACTION ANALYSIS;

PHASE TRANSITIONS;

EID: 65349111240     PISSN: 09476539     EISSN: 15213765     Source Type: Journal    
DOI: 10.1002/chem.200801528     Document Type: Article

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