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{
"id": "paper",
"citation": "Murcia et al., Quantitative and bond-traceable resonant X-ray optical tensors of organic molecules, arXiv:2509.01734; Phys. Rev. Lett. (2026). DOI: 10.1103/rfgg-ffyz",
"url": "https://arxiv.org/abs/2509.01734"
},
{
"id": "dft-learn",
"citation": "WSU Carbon Lab, dft-learn v1.1.0 (software). Source and releases: https://github.com/WSU-Carbon-Lab/dft-learn ; release tag v1.1.",
"url": "https://github.com/WSU-Carbon-Lab/dft-learn/releases/tag/v1.1"
},
{
"id": "atlas-cui",
"citation": "X-ray Atlas NEXAFS Dataset: Cu phthalocyanine, C(K), TRANS, NSLS-II 7-ID-1. Zenodo 10.5281/zenodo.21299145",
"url": "https://xrayatlas.wsu.edu/d/fekpakf0"
},
{
"id": "atlas-si",
"citation": "X-ray Atlas NEXAFS Dataset: Cu phthalocyanine, C(K), TEY, NSLS-II 7-ID-1. Zenodo 10.5281/zenodo.21299147",
"url": "https://xrayatlas.wsu.edu/d/4hdtjecp"
},
{
"id": "geometry-cif",
"citation": "CuPc crystallographic geometry cited in SI: crystal structure of alpha-copper phthalocyanine grown on KCl, Acta Cryst. B 59, 393 (2003).",
"url": "https://scripts.iucr.org/cgi-bin/paper?S0108768103005784"
},
{
"id": "stobe",
"citation": "Hermann & Pettersson, StoBe-deMon (Edmond 10.17617/3.YOLSFH)",
"url": "https://doi.org/10.17617/3.YOLSFH"
},
{
"id": "optical-cupc",
"citation": "WSU Carbon Lab, optical-cupc: packaged CuPc NEXAFS / DFT / clustering assets on Hugging Face Hub.",
"url": "https://huggingface.co/carbon-lab/optical-cupc"
}
]
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