Excited-State Forces with the Gaussian and Augmented Plane Wave Method for the Tamm–Dancoff Approximation of Time-Dependent Density Functional Theory
Sertcan Gökmen, Beliz, Hutter, Jürg, Hehn, Anna-Sophia
Published in Journal of chemical theory and computation (08.10.2024)
Published in Journal of chemical theory and computation (08.10.2024)
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Journal Article
Low-frequency anharmonic couplings in crystalline bromoform: Theory
Sertcan, Beliz, Mousavi, Seyyed Jabbar, Iannuzzi, Marcella, Hamm, Peter
Published in The Journal of chemical physics (07.01.2023)
Published in The Journal of chemical physics (07.01.2023)
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Journal Article
Excited-State Properties for Extended Systems: Efficient Hybrid Density Functional Methods
Hehn, Anna-Sophia, Sertcan, Beliz, Belleflamme, Fabian, Chulkov, Sergey K., Watkins, Matthew B., Hutter, Jürg
Published in Journal of chemical theory and computation (12.07.2022)
Published in Journal of chemical theory and computation (12.07.2022)
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Journal Article
Correction to “Excited-State Properties for Extended Systems: Efficient Hybrid Density Functional Methods”
Hehn, Anna-Sophia, Sertcan, Beliz, Belleflamme, Fabian, Chulkov, Sergey K., Watkins, Matthew B., Hutter, Jürg
Published in Journal of chemical theory and computation (11.06.2024)
Published in Journal of chemical theory and computation (11.06.2024)
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