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【求助】DL-POLY GUI安装
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In addition to compiling the Java source, it is necessary to compile some FORTRAN programs that the GUI calls upon to perform some of the calculations. Inside the java subdirectory are the lower directories RDF, GDF and SKW. These contain programs for calculating radial distribution functions, van Hove correlation functions, and dynamic structure factors respectively. Enter each of these directories and type make to build the FORTRAN programs. This will complete the build of the GUI. Note it may be necessary to change a few of the parameters in the makefiles for these, such as the specification of the FORTRAN77 compiler or the C compiler 安装GUI到这一步不明白了,哪位高手指点指点呗! |
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