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Comment on the application of the spf potential

✍ Scribed by R.H. Tipping

Publisher
Elsevier Science
Year
1980
Tongue
English
Weight
143 KB
Volume
70
Category
Article
ISSN
0009-2614

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✦ Synopsis

The results gwen in a recent paper by Gogawale et al on the apphcatlon of the Sunons-Parr-Fmlan potentml for the determmatlon of the &ssoczatmn energes of &atonuc molecules are shown to be based on nn erroneous analysis

πŸ“œ SIMILAR VOLUMES

Comment on β€œComputing molecular electros
Comment on β€œComputing molecular electrostatic potentials with the PRISM algorithm”
✍ Shridhar R. Gadre; Rajendra N. Shirsat πŸ“‚ Article πŸ“… 1994 πŸ› Elsevier Science 🌐 English βš– 189 KB

A recent Letter by Johnson, Gill, Pople and Fox discussing the computation of the molecular electrostatic potential over a set of points is similar to our earlier studies. A detailed comparison of the two approaches is presented. An extension of our earlier work for the PC/AT and 12%node MIMD machin