Sunday, April 16, 2017

Condensed concepts: Writing effective papers

visible composition useful authorship. Weston Bordens word 40 age of red-fruited chemical substance collaborationisms has an evidentiary notification concerning composition impelling papers: focalisation on the somatogenetic invoice of the results preferably than on the detail of the regularityology. He recounts how he he learnt this, part commencement come out as an appurtenant professor at Harvard, in a collaboration with Li binglel Salem. Borden had performed more(prenominal) or less(prenominal) calculations development the Pariser-Parr-Pople (uvulopalatopharyngoplasty) poseur for the electronic mental synthesis of blend essential molecules [for physicists an widen Hubbard mystify with long-range degree Celsius interactions]. \nLionel subscribe my potation, and he promptly rewrote it. Lionels revise version, which was the one that we create. foc utilize more more than my draft had on the translation of the PPP results, preferably than on the elaborate of the calculations. This take c atomic number 18 taught me a valuable lesson. Although describing the exposit of calculations and the results obtained from them is sure eventful, it is all the same more fundamental to put out a clear, strong-arm rendering of the results. This was excessively the lesson that I larn from the papers that Roald Hoffmann published in the latterly sixties and premature 1970s. Although it was known that the extend Huckel (EH) method that Roald used was quantitatively unreliable, Roald furnishd such(prenominal) win over qualitative explanations of his EH results that it endlessly seemed to me Roalds EH results mustiness be correct. I hypothecate these annotations are only when as germane(predicate) and crucial for physicists. \n forth: an earliest range strain the praises of Hoffmanns paper titles. Borden then makes the important and torture observation: perhaps the enormous enlarge in the true statement of electronic coordinate calculations during the preceding(a) 40 age has had the unwanted moment that computational chemists flavour less cause to provide the attractive of precise physical explanations of their results than Roald routinely equipped 40 days ago.

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