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aebb_v1_0[1].tar
- 半经验量子化学方法的源代码 用来解HF方程,适用于linux系统-Semi-empirical quantum chemistry methods to solution of the source code for HF equation for linux system
qcalc-node.tar
- This a source code of QCALC-NMR parallel quantum chemistry calculations system for a 64bit 8-processor node. Some comments are in KOI8-R.-This is a source code of QCALC-NMR parallel quantum chemistry calculations system for a 64bit 8-processor node.