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MP2-based composite extrapolation schemes can predict core-ionization energies for first-row elements with coupled-cluster level accuracy

Fuente: arXiv

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Detalles Bibliográficos
Autores principales:	Morgunov, Anton, Tran, Henry K., Meitei, Oinam Romesh, Chien, Yu-Che, Van Voorhis, Troy
Formato:	Preprint
Publicado:	2024
Materias:	Chemical Physics Quantum Physics
Acceso en línea:	Acceder al recurso
Etiquetas:	Agregar Etiqueta Sin Etiquetas, Sea el primero en etiquetar este registro!

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