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Molecular Modeling of Inorganic Compunds

By: Contributor(s): Material type: TextTextPublication details: Weinheim WILEY-VCH Verlag Gmbh & Co. 2009Edition: 3rd edDescription: 326pISBN:
  • 9783527317998
DDC classification:
  • 541.22 COM
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Item type Current library Item location Collection Call number Status Date due Barcode Item holds
Reference Book Reference Book NIMA Knowledge Centre 7th Floor Silence Zone Reference 541.22 COM (Browse shelf(Opens below)) Not For Loan P0007275
Total holds: 0

PCG00258 After the second edition introduced first density functional theory aspects, this third edition expands on this topic and offers unique practice in molecular mechanics calculations and DFT. In addition, the tutorial with its interactive exercises has been completely revised and uses the very latest software, a full version of which is enclosed on CD, allowing readers to carry out their own initial experiments with forcefield calculations in organometal and complex chemistry.

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