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Biophysics of Nucleic Acids Celebrating the 75th Birthday of Professor Kenneth J. Breslauer
Year of Publication 2023
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eBook
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Excitonic Features in the Optical Response of Layered Gallium Sulphide
Juan, Dilson, Gutierrez, Yael, Fernandez, Pablo Garcia, Junquera, Javier, Losurdo, Maria, Moreno, Fernando
Published in CAS proceedings (11.10.2023)
Published in CAS proceedings (11.10.2023)
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Conference Proceeding
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Production and catalytic transformation of levulinic acid: A platform for speciality chemicals and fuels
Yan, Kai, Jarvis, Cody, Gu, Jing, Yan, Yong
Published in Renewable & sustainable energy reviews (01.11.2015)
Published in Renewable & sustainable energy reviews (01.11.2015)
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Ab-initio simulation of hydrogenated graphene properties
Murav’ev, V. V., Mishchenka, V. M.
Published in Doklady Belorusskogo gosudarstvennogo universiteta informatiki i radioèlektroniki (01.01.2022)
Published in Doklady Belorusskogo gosudarstvennogo universiteta informatiki i radioèlektroniki (01.01.2022)
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Electronic structure of the S1 state in methylcobalamin: Insight from CASSCF/MC-XQDPT2, EOM-CCSD, and TD-DFT calculations
Kornobis, Karina, Kumar, Neeraj, Lodowski, Piotr, Jaworska, Maria, Piecuch, Piotr, Lutz, Jesse J., Wong, Bryan M., Kozlowski, Pawel M.
Published in Journal of computational chemistry (05.05.2013)
Published in Journal of computational chemistry (05.05.2013)
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Chiroptical Signature and Absolute Configuration of Tröger’s Base-Based Triangular Macrocycles
Palomo, Luis, Cruz, Carlos M., Campaña, Araceli G., Jiang, Bo, Wu, Jishan, Casado, Juan, Ramírez, Francisco J.
Published in ACS omega (25.02.2025)
Published in ACS omega (25.02.2025)
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Correlated wavefunction methods in bioinorganic chemistry
Neese, Frank, Liakos, Dimitrios G., Ye, Shengfa
Published in Journal of biological inorganic chemistry (01.08.2011)
Published in Journal of biological inorganic chemistry (01.08.2011)
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Advanced aspects of ab initio theoretical optical spectroscopy of transition metal complexes: Multiplets, spin-orbit coupling and resonance Raman intensities
Neese, Frank, Petrenko, Taras, Ganyushin, Dmitry, Olbrich, Gottfried
Published in Coordination chemistry reviews (01.02.2007)
Published in Coordination chemistry reviews (01.02.2007)
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Interface between quantum-mechanical-based approaches, experiments, and CALPHAD methodology
Turchi, Patrice E.A., Abrikosov, Igor A., Burton, Benjamin, Fries, Suzana G., Grimvall, Göran, Kaufman, Larry, Korzhavyi, Pavel, Rao Manga, V., Ohno, Munekazu, Pisch, Alexander, Scott, Andrew, Zhang, Wenqing
Published in Calphad (01.03.2007)
Published in Calphad (01.03.2007)
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