Thermochemical prediction program aided with EXAPL and APL2 data structure

Toshio Nishikawa, Ichiro Ogasawara · 1989

A prediction program to calculate thermochemical data, such as enthalpy of formation for organic compounds, is implemented in an APL environment. APL's multi-dimensional array is best matched to chemical atom's multivalency property.APL2 can achieve powerful scientific computaion with dynamic array access and complex number processing. The coding effort is eased with EXAPL.

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