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Accurate Singlet–Triplet Excited States Energy Gap Can Be Mastered by Time-Dependent Density Functional Theory Calculations Based on a Dielectric-Screened Range-Separated Hybrid Functional

Year: 2024
Type: article
Language: English
Open Access status: closed
OpenAlex ID: W4405540282
FWCI: 2.871
Cites: 97
Cited by: 18
Related to: 10