Ab-initio structure determination from X-ray powder data and solid-state DFT study of monohydrate and anhydrous cyclohexanespiro-5′-hydantoin

Zeitschrift fur Kristallographie

Volumn 223, Issue 9, 2008, Pages 591-597

  Chattopadhyay, Basab ^a   Mukherjee, Monika ^a   Kantharaju, ^b   Sureshbabu, Vommina V ^b   Mukherjee, Alok K ^c  

^a DEPARTMENT OF MATERIALS SCIENCE   (India)

^b BANGALORE UNIVERSITY   (India)

^c JADAVPUR UNIVERSITY   (India)

Author keywords

Ab initio structure analysis; Hydantoin derivatives; Powder diffraction structure analysis; Rietveld refinement; Solid state DFT calculation; X ray diffraction

Indexed keywords

EID: 58149346149     PISSN: 00442968     EISSN: None     Source Type: Journal    
DOI: 10.1524/zkri.2008.1125     Document Type: Article

References (40)

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