FRINK Linked Data Fragments server

Matches in SemOpenAlex for { <https://semopenalex.org/work/W1983291273> ?p ?o ?g. }

• W1983291273 endingPage "100" @default.
• W1983291273 startingPage "95" @default.
• W1983291273 abstract "A three-dimensional potential energy surface of the electronic ground state HXeI is constructed from more than 4200 ab initio points at the internally contracted multi-reference configuration interaction with the Davidson correction (icMRCI + Q) level employing large basis sets. The calculations indicate that the linear HXeI molecule is metastable with a barrier of 0.365 eV in the atomization (HXeI → H + Xe + I) channel and a barrier of 1.306 eV in the dissociation (HXeI → HI + Xe) channel. Low-lying vibrational energy levels of both HXeI and DXeI are calculated on the three-dimensional potential energy surface using the Lanczos algorithm, and found to be in good agreement with known experimental band origins." @default.
• W1983291273 created "2016-06-24" @default.
• W1983291273 creator A5022207609 @default.
• W1983291273 creator A5066544142 @default.
• W1983291273 creator A5082485253 @default.
• W1983291273 date "2008-10-01" @default.
• W1983291273 modified "2023-10-17" @default.
• W1983291273 title "An ab initio potential energy surface and vibrational energy levels of HXeI" @default.
• W1983291273 cites W1515705871 @default.
• W1983291273 cites W1516584563 @default.
• W1983291273 cites W1665393863 @default.
• W1983291273 cites W1965476232 @default.
• W1983291273 cites W1984237478 @default.
• W1983291273 cites W1987048083 @default.
• W1983291273 cites W1988287910 @default.
• W1983291273 cites W1992613000 @default.
• W1983291273 cites W1993077801 @default.
• W1983291273 cites W1996220798 @default.
• W1983291273 cites W1996690876 @default.
• W1983291273 cites W1997336125 @default.
• W1983291273 cites W2003679204 @default.
• W1983291273 cites W2012604920 @default.
• W1983291273 cites W2028986283 @default.
• W1983291273 cites W2033042996 @default.
• W1983291273 cites W2041330955 @default.
• W1983291273 cites W2043327592 @default.
• W1983291273 cites W2045357567 @default.
• W1983291273 cites W2050453167 @default.
• W1983291273 cites W2051774577 @default.
• W1983291273 cites W2055913904 @default.
• W1983291273 cites W2056960327 @default.
• W1983291273 cites W2057869699 @default.
• W1983291273 cites W2064569059 @default.
• W1983291273 cites W2067018034 @default.
• W1983291273 cites W2069006374 @default.
• W1983291273 cites W2073125394 @default.
• W1983291273 cites W2077001943 @default.
• W1983291273 cites W2079597682 @default.
• W1983291273 cites W2117686912 @default.
• W1983291273 cites W2119597123 @default.
• W1983291273 cites W2135909913 @default.
• W1983291273 cites W2950016663 @default.
• W1983291273 cites W2952871119 @default.
• W1983291273 cites W2988498132 @default.
• W1983291273 cites W3105938624 @default.
• W1983291273 cites W4240406016 @default.
• W1983291273 doi "https://doi.org/10.1016/j.theochem.2008.07.030" @default.
• W1983291273 hasPublicationYear "2008" @default.
• W1983291273 type Work @default.
• W1983291273 sameAs 1983291273 @default.
• W1983291273 citedByCount "6" @default.
• W1983291273 countsByYear W19832912732012 @default.
• W1983291273 countsByYear W19832912732013 @default.
• W1983291273 countsByYear W19832912732014 @default.
• W1983291273 countsByYear W19832912732020 @default.
• W1983291273 crossrefType "journal-article" @default.
• W1983291273 hasAuthorship W1983291273A5022207609 @default.
• W1983291273 hasAuthorship W1983291273A5066544142 @default.
• W1983291273 hasAuthorship W1983291273A5082485253 @default.
• W1983291273 hasConcept C102931765 @default.
• W1983291273 hasConcept C119256216 @default.
• W1983291273 hasConcept C121332964 @default.
• W1983291273 hasConcept C125277925 @default.
• W1983291273 hasConcept C147789679 @default.
• W1983291273 hasConcept C158693339 @default.
• W1983291273 hasConcept C178790620 @default.
• W1983291273 hasConcept C183971685 @default.
• W1983291273 hasConcept C184779094 @default.
• W1983291273 hasConcept C185592680 @default.
• W1983291273 hasConcept C20501136 @default.
• W1983291273 hasConcept C2781442258 @default.
• W1983291273 hasConcept C32909587 @default.
• W1983291273 hasConcept C41999313 @default.
• W1983291273 hasConcept C62396407 @default.
• W1983291273 hasConcept C62520636 @default.
• W1983291273 hasConcept C69523127 @default.
• W1983291273 hasConcept C84551667 @default.
• W1983291273 hasConcept C89464430 @default.
• W1983291273 hasConceptScore W1983291273C102931765 @default.
• W1983291273 hasConceptScore W1983291273C119256216 @default.
• W1983291273 hasConceptScore W1983291273C121332964 @default.
• W1983291273 hasConceptScore W1983291273C125277925 @default.
• W1983291273 hasConceptScore W1983291273C147789679 @default.
• W1983291273 hasConceptScore W1983291273C158693339 @default.
• W1983291273 hasConceptScore W1983291273C178790620 @default.
• W1983291273 hasConceptScore W1983291273C183971685 @default.
• W1983291273 hasConceptScore W1983291273C184779094 @default.
• W1983291273 hasConceptScore W1983291273C185592680 @default.
• W1983291273 hasConceptScore W1983291273C20501136 @default.
• W1983291273 hasConceptScore W1983291273C2781442258 @default.
• W1983291273 hasConceptScore W1983291273C32909587 @default.
• W1983291273 hasConceptScore W1983291273C41999313 @default.
• W1983291273 hasConceptScore W1983291273C62396407 @default.
• W1983291273 hasConceptScore W1983291273C62520636 @default.
• W1983291273 hasConceptScore W1983291273C69523127 @default.
• W1983291273 hasConceptScore W1983291273C84551667 @default.
• W1983291273 hasConceptScore W1983291273C89464430 @default.
• W1983291273 hasIssue "1-3" @default.

• next