THz to far-infrared spectra of the known crystal polymorphs of Phenylalanine
Fuente:
arXiv
Saved in:
| Main Authors: | Niehaus, Thomas A., Prost, Emilien, Loriot, Vincent, Lépine, Franck, Bergé, Luc, Skupin, Stefan |
|---|---|
| Format: | Preprint |
| Published: |
2024
|
| Subjects: | |
| Online Access: | |
| Tags: |
Add Tag
No Tags, Be the first to tag this record!
|
Similar Items
Automated all-functionals infrared and Raman spectra
by: Bastonero, Lorenzo, et al.
Published: (2023)
by: Bastonero, Lorenzo, et al.
Published: (2023)
Extended study of crystal structures, optical properties and vibrational spectra of polar 2-aminopyrimidinium hydrogen phosphite and bis(2-aminopyrimidinium) sulfate monohydrate and two 2-aminopyrimidinium hydrogen sulfate polymorphs
by: Matulkova, Irena, et al.
Published: (2025)
by: Matulkova, Irena, et al.
Published: (2025)
Ultrafast probing of isotope-induced explciit symmetry breaking in ethylene
by: Nardi, Alessandro Nicola, et al.
Published: (2025)
by: Nardi, Alessandro Nicola, et al.
Published: (2025)
Diverse polymorphism in Ruddlesden-Popper chalcogenides
by: Kayastha, Prakriti, et al.
Published: (2025)
by: Kayastha, Prakriti, et al.
Published: (2025)
Femtosecond Nonadiabatic Confinement of Molecular Dication Yield
by: Marante, Carlos, et al.
Published: (2026)
by: Marante, Carlos, et al.
Published: (2026)
Mathematical crystal chemistry II: Random search for ionic crystals and analysis on oxide crystals registered in ICSD
by: Koshoji, Ryotaro
Published: (2025)
by: Koshoji, Ryotaro
Published: (2025)
Revealing excess protons in the infrared spectrum of liquid water
by: Artemov, V. G., et al.
Published: (2019)
by: Artemov, V. G., et al.
Published: (2019)
The Role of THz Phonons in the Ionic Conduction Mechanism of $Li_7La_3Zr_2O_{12}$ Polymorphs
by: Lin, Amy K., et al.
Published: (2025)
by: Lin, Amy K., et al.
Published: (2025)
Tensorial properties via the neuroevolution potential framework: Fast simulation of infrared and Raman spectra
by: Xu, Nan, et al.
Published: (2023)
by: Xu, Nan, et al.
Published: (2023)
Separate and Detailed Treatment of Absolute Signal and Noise Enables NMR Under Adverse Circumstances
by: Guinness, A, et al.
Published: (2024)
by: Guinness, A, et al.
Published: (2024)
Low-symmetry polymorph of GaP upends bonding paradigms of metallic high-pressure III-V compounds
by: Lavina, Barbara, et al.
Published: (2024)
by: Lavina, Barbara, et al.
Published: (2024)
Mid-infrared intraband transitions in InAs colloidal quantum dots
by: Saha, Shraman Kumar, et al.
Published: (2025)
by: Saha, Shraman Kumar, et al.
Published: (2025)
Rapidly Screening the Correlation Between the Rotational Mobility and the Hydrogen Bonding Strength of Confined Water
by: Beaton, Alec A., et al.
Published: (2023)
by: Beaton, Alec A., et al.
Published: (2023)
Towards superior van der Waals density functionals for molecular crystals
by: Fedorov, Dmitry V., et al.
Published: (2025)
by: Fedorov, Dmitry V., et al.
Published: (2025)
Quantum coherence governs macroscopic polymorphism in organic semiconductors
by: Wang, Hai, et al.
Published: (2026)
by: Wang, Hai, et al.
Published: (2026)
Predictive quantum vibrational spectra through active learning 4G-NNPs
by: Faruque, Md Omar, et al.
Published: (2025)
by: Faruque, Md Omar, et al.
Published: (2025)
How accurate are simulations and experiments for the lattice energies of molecular crystals?
by: Della Pia, Flaviano, et al.
Published: (2024)
by: Della Pia, Flaviano, et al.
Published: (2024)
Imperfections are not 0 K: free energy of point defects in crystals
by: Mosquera-Lois, Irea, et al.
Published: (2023)
by: Mosquera-Lois, Irea, et al.
Published: (2023)
Surface doping of rubrene single crystals by molecular electron donors and acceptors
by: Gatsios, Christos, et al.
Published: (2024)
by: Gatsios, Christos, et al.
Published: (2024)
Ultrahigh ion diffusion in oxide crystal by engineering the interfacial transporter channels
by: Li, Liang, et al.
Published: (2022)
by: Li, Liang, et al.
Published: (2022)
Short-lived memory in multidimensional spectra encodes full signal evolution
by: Sayer, Thomas, et al.
Published: (2026)
by: Sayer, Thomas, et al.
Published: (2026)
Predicting the suitability of photocatalysts for water splitting using Koopmans spectral functionals: The case of TiO$_2$ polymorphs
by: Stojkovic, Marija, et al.
Published: (2024)
by: Stojkovic, Marija, et al.
Published: (2024)
On the electrochemical CO2 reduction by Bi-based catalysts: single crystals or mixture phases
by: Zhou, Mengting, et al.
Published: (2024)
by: Zhou, Mengting, et al.
Published: (2024)
Competing excitonic couplings as origin of mimicked phase transitions in zinc-phthalocyanine single crystals
by: Schraut-May, Lisa, et al.
Published: (2025)
by: Schraut-May, Lisa, et al.
Published: (2025)
Computer Simulation of the Growth of a Metal-Organic Framework Proto-crystal at Constant Chemical Potential
by: Gargari, Sahar Andarzi, et al.
Published: (2025)
by: Gargari, Sahar Andarzi, et al.
Published: (2025)
Mode-selective Raman imaging of metal-organic frameworks reveals surface heterogeneities of single HKUST-1 crystals
by: Ferreira, Matheus Esteves, et al.
Published: (2024)
by: Ferreira, Matheus Esteves, et al.
Published: (2024)
Electrically driven first-order phase transition of a 2D ionic crystal at the electrode/electrolyte interface
by: Angiolari, Federica, et al.
Published: (2025)
by: Angiolari, Federica, et al.
Published: (2025)
Machine learning classification of local environments in molecular crystals
by: Kuroshima, Daisuke, et al.
Published: (2024)
by: Kuroshima, Daisuke, et al.
Published: (2024)
Trion formation resolves observed peak shifts in the optical spectra of transition metal dichalcogenides
by: Sayer, Thomas, et al.
Published: (2023)
by: Sayer, Thomas, et al.
Published: (2023)
Unsupervised identification of crystal defects from atomistic potential descriptors
by: Kývala, Lukáš, et al.
Published: (2024)
by: Kývala, Lukáš, et al.
Published: (2024)
The role of surface spin polarization on ceria-supported Pt nanoparticles
by: Kang, Byungkyun, et al.
Published: (2021)
by: Kang, Byungkyun, et al.
Published: (2021)
Efficient first-principles modeling of complex molecular crystals at sub-chemical accuracy
by: Shi, Benjamin X., et al.
Published: (2026)
by: Shi, Benjamin X., et al.
Published: (2026)
A Pyridyl-Benzimidazole Based Ruthenium(II) Complex as Optical Sensor: Targeted Cyanide Detection and Live Cell Imaging Applications
by: Naithani, Sudhanshu, et al.
Published: (2025)
by: Naithani, Sudhanshu, et al.
Published: (2025)
Inverse-design of two-dimensional magnonic crystals via topology optimization with frequency-domain micromagnetics
by: Nagaoka, Ryunosuke, et al.
Published: (2026)
by: Nagaoka, Ryunosuke, et al.
Published: (2026)
High-throughput computational screening of small, eco-friendly, molecular crystals for sustainable piezoelectric materials
by: Vishnoi, Shubham, et al.
Published: (2024)
by: Vishnoi, Shubham, et al.
Published: (2024)
Establishing baselines for generative discovery of inorganic crystals
by: Szymanski, Nathan J., et al.
Published: (2025)
by: Szymanski, Nathan J., et al.
Published: (2025)
Medium-range structural order in amorphous arsenic
by: Liu, Yuanbin, et al.
Published: (2025)
by: Liu, Yuanbin, et al.
Published: (2025)
Design of novel organic proton-transfer acid-base (anti-)ferroelectric salts with crystal structure prediction
by: Seyedraoufi, Seyedmojtaba, et al.
Published: (2024)
by: Seyedraoufi, Seyedmojtaba, et al.
Published: (2024)
MoSi$_2$N$_4$-like crystals -- the new family of two-dimensional materials
by: Latychevskaia, Tatiana, et al.
Published: (2025)
by: Latychevskaia, Tatiana, et al.
Published: (2025)
Validity of DFT+U band gaps in all its known functional forms
by: Burgess, Andrew C., et al.
Published: (2026)
by: Burgess, Andrew C., et al.
Published: (2026)
Similar Items
-
Automated all-functionals infrared and Raman spectra
by: Bastonero, Lorenzo, et al.
Published: (2023) -
Extended study of crystal structures, optical properties and vibrational spectra of polar 2-aminopyrimidinium hydrogen phosphite and bis(2-aminopyrimidinium) sulfate monohydrate and two 2-aminopyrimidinium hydrogen sulfate polymorphs
by: Matulkova, Irena, et al.
Published: (2025) -
Ultrafast probing of isotope-induced explciit symmetry breaking in ethylene
by: Nardi, Alessandro Nicola, et al.
Published: (2025) -
Diverse polymorphism in Ruddlesden-Popper chalcogenides
by: Kayastha, Prakriti, et al.
Published: (2025) -
Femtosecond Nonadiabatic Confinement of Molecular Dication Yield
by: Marante, Carlos, et al.
Published: (2026)