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Experimental Vibrational Zero-Point Energies: Diatomic Molecules
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10.1063/1.2436891
/content/aip/journal/jpcrd/36/2/10.1063/1.2436891
http://aip.metastore.ingenta.com/content/aip/journal/jpcrd/36/2/10.1063/1.2436891
View: Tables

Tables

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TABLE 1.

Spectroscopic constants for selected diatomic molecules. Standard uncertainties are between parentheses and refer to the least significant digits. Values are in wavenumber units .

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TABLE 2.

Derivatives of ZPE with respect to spectroscopic constants, .

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TABLE 3.

Estimated standard uncertainties associated with some diatomic ZPEs ( units) as determined using the full [Eq. (6)], diagonal [Eq. (7)], and pessimistic [Eq. (8)] approximations.

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TABLE 4.

Truncation bias with respect to sextic diatomic vibrational model [Eqs. (9)–(13)]. The order of the fitting polynomial is .

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TABLE 5.

Experimental vibrational zero-point energies for selected diatomic molecules. Combined standard uncertainties (1) are between parentheses and refer to the least significant digit. The combined uncertainties include both the estimated statistical uncertainties and the estimated uncertainties arising from truncation bias .

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/content/aip/journal/jpcrd/36/2/10.1063/1.2436891
2007-04-18
2014-04-25
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752b84549af89a08dbdd7fdb8b9568b5 journal.articlezxybnytfddd
Scitation: Experimental Vibrational Zero-Point Energies: Diatomic Molecules
http://aip.metastore.ingenta.com/content/aip/journal/jpcrd/36/2/10.1063/1.2436891
10.1063/1.2436891
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