Relativistic and nonrelativistic finite nucleus optimized double zeta basis sets for the 4p, 5p and 6p elements (Theor Chem Acc (1998) 99:366-371): addendum |
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| Authors: | Kenneth G. Dyall |
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| Affiliation: | Schr?dinger, Inc., 1500 SW First Avenue, Suite 1180, Portland, OR 97201, USA, US
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| Abstract: | The coefficients of the atomic Foldy-Wout-huysen transformed large component, which can be used in scalar relativistic calculations, are provided in an internet archive for the relativistic double zeta basis sets for the 4p, 5p and 6p elements previously published by the author. Published online: 14 November 2002 Correspondence to: K.G. Dyall e-mail: dyall@schrodinger.com |
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| Keywords: | : Gaussian basis sets – Relativistic basis sets – p Block – Double zeta – Contraction coefficients |
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