Nonadiabatic corrections to rovibrational levels of H2

dc.contributor.authorPachucki, Krzysztof
dc.contributor.authorKomasa, Jacek
dc.date.accessioned2010-03-18T13:50:34Z
dc.date.available2010-03-18T13:50:34Z
dc.date.issued2009
dc.description.abstractThe leading nonadiabatic corrections to rovibrational levels of a diatomic molecule are expressed in terms of three functions of internuclear distance: corrections to the adiabatic potential, the effective nuclear mass, and the effective moment of inertia. The resulting radial Schrödinger equation for nuclear motion is solved numerically yielding accurate nonadiabatic energies for all rovibrational levels of the H2 molecule. Results for states with J ≤ 10 are in excellent agreement with previous calculations by Wolniewicz, and for states with J>10 are new.pl_PL
dc.identifier.citationJ. Chem. Phys. 130, 164113 (2009)pl_PL
dc.identifier.issn0021-9606
dc.identifier.urihttp://hdl.handle.net/10593/200
dc.language.isoen_USpl_PL
dc.publisherAmerican Institute of Physicspl_PL
dc.subjectNonadiabatic correctionspl_PL
dc.subjectRovibrational levelspl_PL
dc.subjectEffective nuclear masspl_PL
dc.subjectRadial Schrödinger equationpl_PL
dc.subjectHydrogen moleculepl_PL
dc.subjectCorrelated Gaussian functionspl_PL
dc.titleNonadiabatic corrections to rovibrational levels of H2pl_PL
dc.typeArtykułpl_PL

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Uniwersytet im. Adama Mickiewicza w Poznaniu
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