Photophysical properties of nickel and palladium complexes with corrin and porphyrin from the perspective of theoretical calculations
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下载链接：
https://repod.icm.edu.pl/citation?persistentId=doi:10.18150/EJPJYP
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资源简介：
The dataset contains DFT, TDDFT, and NEVPT2 calculations for nickel and palladium complexes with corrin and porphyrin. The calculations include ground-state and triplet-state geometry optimizations, electronic spectra, emission spectra, SOC coefficients, and NEVPT2 spectra.
提供机构：
RepOD
创建时间：
2026-01-08
