Sökning: id:"swepub:oai:DiVA.org:ltu-3131" > The H2–H complex :
Fältnamn | Indikatorer | Metadata |
---|---|---|
000 | 02391naa a2200337 4500 | |
001 | oai:DiVA.org:ltu-3131 | |
003 | SwePub | |
008 | 160929s2003 | |||||||||||000 ||eng| | |
024 | 7 | a https://urn.kb.se/resolve?urn=urn:nbn:se:ltu:diva-31312 URI |
024 | 7 | a https://doi.org/10.1063/1.15296812 DOI |
040 | a (SwePub)ltu | |
041 | a engb eng | |
042 | 9 SwePub | |
072 | 7 | a ref2 swepub-contenttype |
072 | 7 | a art2 swepub-publicationtype |
100 | 1 | a Gustafsson, Magnusu University of Texas, Physics Department4 aut0 (Swepub:ltu)maggus |
245 | 1 0 | a The H2–H complex :b Interaction-induced dipole surface and infrared absorption spectra |
264 | 1 | b AIP Publishing,c 2003 |
338 | a print2 rdacarrier | |
500 | a Upprättat; 2003; 20141020 (maggus) | |
520 | a A quantum chemical dipole surface of interacting H2–H pairs is obtained and collision-induced absorption spectra are computed for temperatures from 200 to 1000 K and frequencies from 0 to 6000 cm−1. The effect of the anisotropy of the potential energy is investigated and turns out to be almost negligible at the temperature for which a close-coupled quantum calculation was done. The smallness of the effect stems from the short range character of the anisotropic potential components for H2–H. Accordingly the isotropic potential approximation could be applied in most of the present calculations. The accuracy of the dipole surface as well as that of the ab initiopotential energy surface that enters the calculations of the spectra are believed to permit prediction of absolute spectral intensities with an accuracy in the 5% range. | |
650 | 7 | a NATURVETENSKAPx Fysikx Annan fysik0 (SwePub)103992 hsv//swe |
650 | 7 | a NATURAL SCIENCESx Physical Sciencesx Other Physics Topics0 (SwePub)103992 hsv//eng |
653 | a Tillämpad fysik | |
653 | a Tillämpad fysik | |
700 | 1 | a Frommhold, Lotharu University of Texas, Physics Department4 aut |
700 | 1 | a Meyer, Wilfriedu Fachbereich Chemie, Universität Kaiserslautern, Germany4 aut |
710 | 2 | a University of Texas, Physics Departmentb Fachbereich Chemie, Universität Kaiserslautern, Germany4 org |
773 | 0 | t Journal of Chemical Physicsd : AIP Publishingg 118:4, s. 1667-1472q 118:4<1667-1472x 0021-9606x 1089-7690 |
856 | 4 8 | u https://urn.kb.se/resolve?urn=urn:nbn:se:ltu:diva-3131 |
856 | 4 8 | u https://doi.org/10.1063/1.1529681 |
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