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Density functional theory study on LDFBDB and its derivatives: Electronic structures, energies, and molecular properties

โœ Scribed by Zhao-Ming Xue; Wei Zhou; Bin-Bin Sun; Chun-Hua Chen

Book ID
113596319
Publisher
Elsevier Science
Year
2011
Tongue
English
Weight
417 KB
Volume
56
Category
Article
ISSN
0013-4686

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๐Ÿ“œ SIMILAR VOLUMES

Density functional theory study on LBDOB
Density functional theory study on LBDOB and its derivatives: Electronic structures, energies, and molecular properties
โœ Zhao-Ming Xue; Jia Ding; Wei Zhou; Chun-Hua Chen ๐Ÿ“‚ Article ๐Ÿ“… 2010 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 504 KB

Theoretical studies on unsymmetrical electrolyte salts, lithium [1,2-benzenediolato(2-)-O,O oxalato]borate (LBDOB), and its derivatives, lithium bis[1,2-benzenediolato(2-)-O,O ]borate (LBBB), and lithium bis(oxalate)borate (LBOB) are carried out using density functional theory (DFT) method and B3LYP