Sfoglia per Autore
Understanding and Controlling the Dielectric Response of Metal–Organic Frameworks
2018-01-01 Ryder, Matthew R.; Donà, Lorenzo; Vitillo, Jenny G.; Civalleri, Bartolomeo*
Extending and assessing composite electronic structure methods to the solid state
2019-01-01 Dona L.; Brandenburg J.G.; Civalleri B.
Impact of Pressure and Temperature on the Broadband Dielectric Response of the HKUST-1 Metal-Organic Framework
2019-01-01 Babal A.S.; Dona L.; Ryder M.R.; Titov K.; Chaudhari A.K.; Zeng Z.; Kelley C.S.; Frogley M.D.; Cinque G.; Civalleri B.; Tan J.-C.
Elucidating the Drug Release from Metal-Organic Framework Nanocomposites via in Situ Synchrotron Microspectroscopy and Theoretical Modeling
2020-01-01 Souza B.E.; Dona' L.; Titov K.; Bruzzese P.; Zeng Z.; Zhang Y.; Babal A.S.; Moslein A.F.; Frogley M.D.; Wolna M.; Cinque G.; Civalleri B.; Tan J.-C.
Cost-effective composite methods for large-scale solid-state calculations
2020-01-01 Dona' L.; Brandenburg J.G.; Bush I.J.; Civalleri B.
Tunable Fluorescein-Encapsulated Zeolitic Imidazolate Framework-8 Nanoparticles for Solid-State Lighting
2021-01-01 Xiong T.; Zhang Y.; Dona' L.; Gutierrez M.; Moslein A.F.; Babal A.S.; Amin N.; Civalleri B.; Tan J.-C.
Defect Engineering in Metal-Organic Framework Nanocrystals: Implications for Mechanical Properties and Performance
2022-01-01 Möslein, Annika F; Donà, Lorenzo; Civalleri, Bartolomeo; Tan, Jin-Chong
Metal-organic frameworks properties from hybrid density functional approximations
2022-01-01 Donà, Lorenzo; Brandenburg, Jan Gerit; Civalleri, Bartolomeo
Structure-Property Relationship of Piezoelectric Properties in Zeolitic Imidazolate Frameworks: A Computational Study
2022-01-01 Mula, Srinidhi; Donà, Lorenzo; Civalleri, Bartolomeo; van der Veen, Monique A
Synthesis, Crystal Structure, and Photocatalytic Properties of Two Isoreticular Ce(IV)-MOFs with an Infinite Rod-Shaped Inorganic Building Unit
2023-01-01 Gosch, Jonas; Morelli Venturi, Diletta; Svensson Grape, Erik; Atzori, Cesare; Donà, Lorenzo; Steinke, Felix; Otto, Tobias; Tjardts, Tim; Civalleri, Bartolomeo; Lomachenko, Kirill A; Inge, A Ken; Costantino, Ferdinando; Stock, Norbert
Unlocking Diabetic Acetone Vapor Detection by A Portable Metal-Organic Framework-Based Turn-On Optical Sensor Device
2023-01-01 Mollick, Samraj; Rai, Sujeet; Frentzel-Beyme, Louis; Kachwal, Vishal; Donà, Lorenzo; Schürmann, Dagmar; Civalleri, Bartolomeo; Henke, Sebastian; Tan, Jin-Chong
A Fresh Look at a Well-Known Solid: Structure, Vibrational Spectra, and Formation Energy of NaNH2
2023-01-01 Bonometti, L; Kraus, F; Graubner, T; Karttunen, AJ; Civalleri, B; Dona, Lorenzo; Maschio, L
Theoretical prediction of nanosizing effects and role of additives in the decomposition of Mg(BH4)2
2024-01-01 Stefano Pantaleone; Elisa Albanese; Lorenzo Donà; Marta Corno; Marcello Baricco; Bartolomeo Civalleri
| Titolo | Data di pubblicazione | Autore(i) | File |
|---|---|---|---|
| Understanding and Controlling the Dielectric Response of Metal–Organic Frameworks | 2018 | Ryder, Matthew R.; Donà, Lorenzo; Vitillo, Jenny G.; Civalleri, Bartolomeo* | |
| Extending and assessing composite electronic structure methods to the solid state | 2019 | Dona L.; Brandenburg J.G.; Civalleri B. | |
| Impact of Pressure and Temperature on the Broadband Dielectric Response of the HKUST-1 Metal-Organic Framework | 2019 | Babal A.S.; Dona L.; Ryder M.R.; Titov K.; Chaudhari A.K.; Zeng Z.; Kelley C.S.; Frogley M.D.; Cinque G.; Civalleri B.; Tan J.-C. | |
| Elucidating the Drug Release from Metal-Organic Framework Nanocomposites via in Situ Synchrotron Microspectroscopy and Theoretical Modeling | 2020 | Souza B.E.; Dona' L.; Titov K.; Bruzzese P.; Zeng Z.; Zhang Y.; Babal A.S.; Moslein A.F.; Frogley M.D.; Wolna M.; Cinque G.; Civalleri B.; Tan J.-C. | |
| Cost-effective composite methods for large-scale solid-state calculations | 2020 | Dona' L.; Brandenburg J.G.; Bush I.J.; Civalleri B. | |
| Tunable Fluorescein-Encapsulated Zeolitic Imidazolate Framework-8 Nanoparticles for Solid-State Lighting | 2021 | Xiong T.; Zhang Y.; Dona' L.; Gutierrez M.; Moslein A.F.; Babal A.S.; Amin N.; Civalleri B.; Tan J.-C. | |
| Defect Engineering in Metal-Organic Framework Nanocrystals: Implications for Mechanical Properties and Performance | 2022 | Möslein, Annika F; Donà, Lorenzo; Civalleri, Bartolomeo; Tan, Jin-Chong | |
| Metal-organic frameworks properties from hybrid density functional approximations | 2022 | Donà, Lorenzo; Brandenburg, Jan Gerit; Civalleri, Bartolomeo | |
| Structure-Property Relationship of Piezoelectric Properties in Zeolitic Imidazolate Frameworks: A Computational Study | 2022 | Mula, Srinidhi; Donà, Lorenzo; Civalleri, Bartolomeo; van der Veen, Monique A | |
| Synthesis, Crystal Structure, and Photocatalytic Properties of Two Isoreticular Ce(IV)-MOFs with an Infinite Rod-Shaped Inorganic Building Unit | 2023 | Gosch, Jonas; Morelli Venturi, Diletta; Svensson Grape, Erik; Atzori, Cesare; Donà, Lorenzo; Steinke, Felix; Otto, Tobias; Tjardts, Tim; Civalleri, Bartolomeo; Lomachenko, Kirill A; Inge, A Ken; Costantino, Ferdinando; Stock, Norbert | |
| Unlocking Diabetic Acetone Vapor Detection by A Portable Metal-Organic Framework-Based Turn-On Optical Sensor Device | 2023 | Mollick, Samraj; Rai, Sujeet; Frentzel-Beyme, Louis; Kachwal, Vishal; Donà, Lorenzo; Schürmann, Dagmar; Civalleri, Bartolomeo; Henke, Sebastian; Tan, Jin-Chong | |
| A Fresh Look at a Well-Known Solid: Structure, Vibrational Spectra, and Formation Energy of NaNH2 | 2023 | Bonometti, L; Kraus, F; Graubner, T; Karttunen, AJ; Civalleri, B; Dona, Lorenzo; Maschio, L | |
| Theoretical prediction of nanosizing effects and role of additives in the decomposition of Mg(BH4)2 | 2024 | Stefano Pantaleone; Elisa Albanese; Lorenzo Donà; Marta Corno; Marcello Baricco; Bartolomeo Civalleri |
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