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- W2021675771 abstract "The Xα transition state method for ionisation is analysed in terms of an interpolating functional and the manner in which relaxation effects are incorporated is explained. For ionisation within unrestricted Hartree—Fock theory the transition state and transition operator methods are shown to be identical." @default.
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- W2021675771 title "Interpolating functionals in relation to the transition state and transition operator methods" @default.
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