@article { ISI:000241574500031,
	title = {Analytically continued fock space multi-reference coupled-cluster theory: application to the shape resonance},
	journal = {Chemical Physics},
	volume = {329},
	number = {1-3, SI},
	year = {2006},
	month = {OCT},
	pages = {283-289},
	publisher = {ELSEVIER SCIENCE BV},
	type = {Article},
	address = {PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS},
	abstract = {<p>The Fock space multi-reference coupled-cluster (FSMRCC) method is used for the study of the shape resonance energy and width in an electron-atom/molecule collision. The procedure is based upon combining a complex absorbing potential (CAP) with FSMRCC theory. Accurate resonance parameters are obtained by solving a small non-Hermitian eigen-value problem. We study the shape resonances in e(-)-C2H4 and e(-)-Mg. (c) 2006 Elsevier B.V. All rights reserved.</p>},
	keywords = {complex absorbing potential, correlated independent particle potential, Fock space multi-reference coupled-cluster theory, shape resonance},
	issn = {0301-0104},
	doi = {10.1016/j.chemphys.2006.07.002},
	author = {Pal, Sourav and Sajeev, Y. and Vaval, Nayana}
}
@article {42681,
	title = {Ab initio lifetimes in the interatomic coulombic decay of neon clusters computed with propagators},
	journal = {Journal of Chemical Physics},
	volume = {126},
	year = {2007},
	month = {APR},
	pages = {Article No. 164110},
	type = {Article},
	doi = {10.1063/1.2723117},
	author = {Vaval, Nayana and Cederbaum, Lorenz S.}
}
@article {45660,
	title = {Auger decay rates of core hole states using equation of motion coupled cluster method},
	journal = {Chemical Physics},
	volume = {482  },
	year = {2017},
	month = {JAN},
	pages = {160-164},
	type = {Article},
	abstract = {The recent development of Linac coherent light source high intense X-ray laser makes it possible to create double core ionization in the molecule. The generation of double core hole state and its decay is identified by Auger spectroscopy. The decay of this double core hole (DCH) states can be used as a powerful spectroscopic tool in chemical analysis. In the present work, we have implemented a promising approach, known as CAP-EOMCC method, which is a combination of complex absorbing potential (CAP) and equation -of-motion coupled cluster (EOMCC) approach to calculate the lifetime of single and double core hole states. We have applied this method to calculate the lifetime of the single core hole (K-LL) and double core hole (KK-KLL) states of CH4, NH3 and HF molecules. The predicted lifetime is found to be extremely short. (C) 2016 Elsevier B.V. All rights reserved.},
	doi = {10.1016/j.chemphys.2016.09.038},
	author = {Ghosh, Aryya and Vaval, Nayana and Pal, Sourav}
}
