Changyan Zhu, Xingxing Zhang, Min Zhang, Yun Geng, Xingman Liu, Zhongmin Su. Insight into spin-orbital interaction using MCSCF method: A special analysis of the 1Σg+ electronic state in C2 and the linear polyacetylenic C4 and C6. Journal of Computational Chemistry, 40(13):1338-1343, 2019. [doi]
Abstract is missing.