2026-10-06T10:37:10Z https://api.figshare.com/v2/oai

oai:figshare.com:article/33994752 2026-10-02T14:23:34Z category_25252 portal_549 item_type_3 month_year_10_2026

Core-level and valence band spectroscopy data and calculations for imidazole Rebecca Ingle (8229741) David Holland (25109571) Eva Muchova (25109572) Physical chemistry not elsewhere classified imidazole spectroscopy <p dir="ltr">Dataset for all figures in associated manuscript. The dataset includes high-resolution resonant Auger electron spectroscopy measurements of imidazole at both the nitrogen and carbon K-edges, combined with complementary quantum chemical simulations. Valence band core level photoelectron spectra are also included as well as polarisation dependent measurements. Quantum chemical calculations include RASPT2 simulations to simulate spectral features and intensities. Data is all available in text based formats.</p> 2026-10-02T14:23:34Z Dataset Dataset 10.5522/04/33994752.v1 https://figshare.com/articles/dataset/Core-level_and_valence_band_spectroscopy_data_and_calculations_for_imidazole/33994752 CC BY-NC-SA 4.0