Cover Image

Mimyria: Machine learned vibrational spectroscopy for aqueous systems made simple

Fuente: arXiv

Saved in:

Bibliographic Details
Main Author:	Schienbein, Philipp
Format:	Preprint
Published:	2026
Subjects:	Chemical Physics
Online Access:	Acceder al recurso
Tags:	Add Tag No Tags, Be the first to tag this record!

Similar Items

Probing the Temporal Response of Liquid Water to a THz Pump Pulse Using Machine Learning-Accelerated Non-Equilibrium Molecular Dynamics
by: Joll, Kit, et al.
Published: (2025)

Molecular dynamics simulation with finite electric fields using Perturbed Neural Network Potentials
by: Joll, Kit, et al.
Published: (2024)

Harmonic-to-anharmonic thermodynamic integration made simple using REG TI
by: Kapil, Venkat
Published: (2026)

Surface charge pattern: impact on vibrational spectroscopy and physics of charged interfaces
by: Chen, Wanlin, et al.
Published: (2025)

The resolution of the weak-exchange limit made rigorous, simple and general in binuclear complexes
by: Sergentu, Dumitru-Claudiu, et al.
Published: (2023)

Two-dimensional IR-Raman spectroscopy of vibrational polaritons: Role of dipole surfaces
by: Ji, Xinwei, et al.
Published: (2026)

Disentangling collective coupling in vibrational polaritons with double quantum coherence spectroscopy
by: Schnappinger, Thomas, et al.
Published: (2024)

Precision Franck-Condon spectroscopy from highly-excited vibrational states
by: Pannir-Sivajothi, Sindhana, et al.
Published: (2024)

Enhancement of vibrationally assisted energy transfer by proximity to exceptional points, probed by fluorescence-detected vibrational spectroscopy
by: Li, Zeng-Zhao, et al.
Published: (2023)

Addressing intramolecular vibrational redistribution in a single molecule through pump and probe surface-enhanced vibrational spectroscopy
by: Loirette-Pelous, Aurelian, et al.
Published: (2026)

Correlated vibration-solvent and Duschinsky effects on electron transfer dynamics and optical spectroscopy
by: Zhu, Zi-Fan, et al.
Published: (2025)

Quantum-logic spectroscopy of forbidden vibrational transitions in single nitrogen molecular ions
by: Shlykov, Aleksandr, et al.
Published: (2026)

Revealing the molecular structures of a-Al2O3(0001)-water interface by machine learning based computational vibrational spectroscopy
by: Du, Xianglong, et al.
Published: (2024)

Accelerating molecular vibrational spectra simulations with a physically informed deep learning model
by: Chen, Yuzhuo, et al.
Published: (2024)

Broadband impulsive stimulated Raman spectroscopy reveals electronic state-specific vibronic coupling and vibrational coherence transfer through nonadiabatic electronic coupling
by: Kaur, Ramandeep, et al.
Published: (2026)

Mechanisms of isotope exchange between aqueous solutions and barite in low-temperature geochemical systems
by: Zhu, Chen, et al.
Published: (2025)

High-resolution ro-vibrational and rotational spectroscopy of the open-shell, linear CCH$^+$ ion ($^3Π$)
by: Steenbakkers, Kim, et al.
Published: (2026)

Rotational energy levels in the ground vibrational state of methane with kHz-level accuracy from comb-referenced double-resonance and Lamb-dip spectroscopies
by: de Oliveira, Vinicius Silva, et al.
Published: (2026)

Vib2Mol: from vibrational spectra to molecular structures-a unified deep learning framework
by: Lu, Xinyu, et al.
Published: (2025)

A simple approach to rotationally invariant machine learning of avector quantity
by: Martinka, Jakub, et al.
Published: (2024)

Coherent nonlinear optical probe for cavity-dressed vibrational mode mixing: multidimensional double-quantum coherence and photon-echo spectroscopy
by: Debnath, Arunangshu
Published: (2025)

Predictive quantum vibrational spectra through active learning 4G-NNPs
by: Faruque, Md Omar, et al.
Published: (2025)

Probing aqueous interfaces with spin defects
by: Castillo, Alfonso, et al.
Published: (2025)

Linear and nonlinear vibrational excitation driven by molecular polaritons
by: Ying, Wenxiang, et al.
Published: (2026)

Phase-sensitive tip-enhanced sum frequency generation spectroscopy using temporally asymmetric pulse for detecting weak vibrational signals
by: Sakurai, Atsunori, et al.
Published: (2025)

Ab initio machine learning simulation of calcium carbonate from aqueous solutions to the solid state
by: Piaggi, Pablo M., et al.
Published: (2024)

A Molecular Density Functional Theory of aqueous electrolytic solution
by: Jeanmairet, Guillaume, et al.
Published: (2025)

Nonlocal van der Waals density functional made faster
by: Laikov, Dimitri N.
Published: (2025)

Transferability and interpretability of vibrational normalizing-flow coordinates
by: Vogt, Emil, et al.
Published: (2025)

Neural canonical transformations for vibrational spectra of molecules
by: Zhang, Qi, et al.
Published: (2024)

The quantum nature of ubiquitous vibrational features revealed for ethylene glycol
by: Nandi, Apurba, et al.
Published: (2025)

Atomic momentum distributions in polyatomic molecules in rotational-vibrational eigenstates
by: Sakaguchi, Sota, et al.
Published: (2024)

Terahertz-induced local-field dynamics and transient birefringence in aqueous electrolytes
by: Kaliannan, Naveen Kumar, et al.
Published: (2026)

Retrieving genuine nonlinear Raman responses in ultrafast spectroscopy via deep learning
by: Fumero, Giuseppe, et al.
Published: (2023)

Machine learning potentials for redox chemistry in solution
by: Kocer, Emir, et al.
Published: (2024)

Post-CCSD(T) corrections to bond distances and vibrational frequencies: the power of $Λ$
by: Spiegel, Maciej, et al.
Published: (2023)

Molecular vibrational mid-IR radiation amplified by high-biased graphene
by: Hong, Sunhwa, et al.
Published: (2025)

Extending the rotational spectrum of cyclopentadiene towards higher frequencies and vibrational states
by: Bonah, Luis, et al.
Published: (2025)

Exact mid-IR quantum vibrational spectra of neutral water clusters
by: Tran, Henry K., et al.
Published: (2025)

Trotter simulation of vibrational Hamiltonians on a quantum computer
by: Malpathak, Shreyas, et al.
Published: (2025)