Speciation of radioactive nuclides is one of the most important factors in the study of migration and precipitation of the nuclides related to deep geological disposal of high level radwastes (HLW). Theoretical speciation analysis with thermodynamic equilibrium codes is an effective method. The authors have employed the EQ3NR, a computer program for geochemical aqueous speciation-solubility calculation, to evaluate the speciation of the key nuclides in the groundwater of Beishan Area, a potential area for hosting the HLW Repository of China. The calculated results showed that pH value as well as chemical composition of the water had a great impact on the speciation of key nuclides, such as Np, Pu, Am, U and Th, which would be released from HLW to the groundwater of Beishan Area. In addition, it was found that the speciation of nuclides varied from one to another. However, under alkaline conditions, the speciations were relatively simpler and hydroxyl complexes and carbonate complexes were dominant.