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Physical Chemistry

Working Paper

Vibrational Spectra of Liquid Interfaces with A 100 kHz Sub-1 cm-1 High Resolution Broadband Sum Frequency Generation Vibrational Spectrometer (HR-BB-SFG-VS)

Jingming Cao, An-An Liu, Shuyi Yang, Xing-xing Peng, Hongfei Wang

Version 1 posted 15 May 2023

504

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Materials Chemistry

Working Paper

Monitoring water harvesting in metal-organic frameworks, one water molecule at a time

Kelly M. Hunter, Francesco Paesani

Version 1 posted 01 December 2023

130

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Theoretical and Computational Chemistry

Working Paper

Boosting the Modeling of InfraRed and Raman Spectra of Bulk Phase Chromophores with Machine Learning

Abir KEBABSA, François MAUREL, Éric BRÉMOND

Version 2 posted 18 July 2024

157

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Physical Chemistry

Working Paper

Interplay between Anion-Receptor and Anion-Solvent Interactions in Halide Receptor Complexes Characterized with Ultrafast Infrared Spectroscopies

Jessika Dean, Caroline Cramer, Joseph Fournier

Version 1 posted 04 June 2024

101

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1

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Physical Chemistry

Working Paper

2D-IR spectroscopy of azide-labeled carbohydrates in H2O

Philip Gasse, Till Stensitzki, Henrike M. Müller-Werkmeister

Version 1 posted 25 June 2024

139

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Physical Chemistry

Working Paper

Coherent anti-Stokes hyper-Raman Spectroscopy

Kazuki Inoue, Masanari Okuno

Version 1 posted 20 March 2024

294

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Theoretical and Computational Chemistry

Working Paper

Quantum-chemical calculation of two-dimensional infrared spectra using localized-mode VSCF/VCI

Julia Brüggemann, Mario Wolter, Christoph Jacob

Version 2 posted 14 December 2022

254

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Theoretical and Computational Chemistry

Working Paper

Consistent analytical second derivatives of the Kohn–Sham DFT energy in the framework of the Conductor-like screening Model (COSMO) through Gaussian charge distributions

Ansgar Pausch

Version 1 posted 12 January 2024

153

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Physical Chemistry

Working Paper

Disentangling Coupling Effects in the Infrared Spectra of Liquid Water

Kelly M. Hunter, Farnaz A. Shakib, Paesani Lab

Version 1 posted 12 October 2018

825

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Physical Chemistry

Working Paper

Coherent Phonon Catalysts: Lattice Vibrations Drive a Photoinduced Phase Transition in a Molecular Crystal

Christopher Rich, Renee Frontiera

Version 1 posted 20 January 2020

770

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50 results in vibrational spectroscopy in Keywords: vibrational spectroscopy

Vibrational Spectra of Liquid Interfaces with A 100 kHz Sub-1 cm-1 High Resolution Broadband Sum Frequency Generation Vibrational Spectrometer (HR-BB-SFG-VS)

Monitoring water harvesting in metal-organic frameworks, one water molecule at a time

Boosting the Modeling of InfraRed and Raman Spectra of Bulk Phase Chromophores with Machine Learning

Interplay between Anion-Receptor and Anion-Solvent Interactions in Halide Receptor Complexes Characterized with Ultrafast Infrared Spectroscopies

2D-IR spectroscopy of azide-labeled carbohydrates in H2O

Coherent anti-Stokes hyper-Raman Spectroscopy

Quantum-chemical calculation of two-dimensional infrared spectra using localized-mode VSCF/VCI

Consistent analytical second derivatives of the Kohn–Sham DFT energy in the framework of the Conductor-like screening Model (COSMO) through Gaussian charge distributions

Disentangling Coupling Effects in the Infrared Spectra of Liquid Water

Coherent Phonon Catalysts: Lattice Vibrations Drive a Photoinduced Phase Transition in a Molecular Crystal

50 results in Keywords: vibrational spectroscopy