FRINK Linked Data Fragments server

Matches in SemOpenAlex for { <https://semopenalex.org/work/W2321402010> ?p ?o ?g. }

• W2321402010 endingPage "7015" @default.
• W2321402010 startingPage "7004" @default.
• W2321402010 abstract "In this work, the He–I (21.218 eV) photoelectron spectrum of d,l-alanine in the gas phase is revisited experimentally and theoretically. To support the experiment, the high level ab initio calculations were used to calculate and assign the photoelectron spectra of the four most stable conformers of gaseous alanine, carefully. The symmetry adapted cluster/configuration interaction (SAC-CI) method based on single and double excitation operators (SD-R) and its more accurate version, termed general-R, was used to separately calculate the energies and intensities of the ionization bands of the l- and d-alanine conformers. The intensities of ionization bands were calculated based on the monopole approximation. Also, natural bonding orbital (NBO) calculations were employed for better spectral band assignment. The relative electronic energy, Gibbs free energy, and Boltzmann population ratio of the conformers were calculated at the experimental temperature (403 K) using several theoretical methods. The theoretical photoelectron spectrum of alanine was calculated by summing over the spectra of individual d and l conformers weighted by different population ratios. Finally, the population ratio of the four most stable conformers of alanine was estimated from the experimental photoelectron spectrum using theoretical calculations for the first time." @default.
• W2321402010 created "2016-06-24" @default.
• W2321402010 creator A5017769947 @default.
• W2321402010 creator A5039810933 @default.
• W2321402010 creator A5040320969 @default.
• W2321402010 date "2012-06-21" @default.
• W2321402010 modified "2023-10-13" @default.
• W2321402010 title "Theoretical and Experimental Study of Valence Photoelectron Spectrum of <scp>d</scp>,<scp>l</scp>-Alanine Amino Acid" @default.
• W2321402010 cites W1965087280 @default.
• W2321402010 cites W1965373089 @default.
• W2321402010 cites W1971270319 @default.
• W2321402010 cites W1973083810 @default.
• W2321402010 cites W1975606596 @default.
• W2321402010 cites W1976376961 @default.
• W2321402010 cites W1982279743 @default.
• W2321402010 cites W1987279057 @default.
• W2321402010 cites W1997103302 @default.
• W2321402010 cites W1997366126 @default.
• W2321402010 cites W2006460264 @default.
• W2321402010 cites W2013891125 @default.
• W2321402010 cites W2016951147 @default.
• W2321402010 cites W2019923061 @default.
• W2321402010 cites W2021908552 @default.
• W2321402010 cites W2022065627 @default.
• W2321402010 cites W2023271753 @default.
• W2321402010 cites W2028719044 @default.
• W2321402010 cites W2030653596 @default.
• W2321402010 cites W2031291966 @default.
• W2321402010 cites W2035525853 @default.
• W2321402010 cites W2038027208 @default.
• W2321402010 cites W2040219444 @default.
• W2321402010 cites W2040756185 @default.
• W2321402010 cites W2041355189 @default.
• W2321402010 cites W2044940178 @default.
• W2321402010 cites W2064168595 @default.
• W2321402010 cites W2072636728 @default.
• W2321402010 cites W2073984614 @default.
• W2321402010 cites W2074464220 @default.
• W2321402010 cites W2077139414 @default.
• W2321402010 cites W2085930789 @default.
• W2321402010 cites W2087884984 @default.
• W2321402010 cites W2090930879 @default.
• W2321402010 cites W2107835528 @default.
• W2321402010 cites W2138593180 @default.
• W2321402010 cites W2143625894 @default.
• W2321402010 cites W2143981217 @default.
• W2321402010 cites W2159780697 @default.
• W2321402010 cites W2164856886 @default.
• W2321402010 cites W29685155 @default.
• W2321402010 doi "https://doi.org/10.1021/jp3023716" @default.
• W2321402010 hasPubMedId "https://pubmed.ncbi.nlm.nih.gov/22720731" @default.
• W2321402010 hasPublicationYear "2012" @default.
• W2321402010 type Work @default.
• W2321402010 sameAs 2321402010 @default.
• W2321402010 citedByCount "25" @default.
• W2321402010 countsByYear W23214020102013 @default.
• W2321402010 countsByYear W23214020102014 @default.
• W2321402010 countsByYear W23214020102015 @default.
• W2321402010 countsByYear W23214020102016 @default.
• W2321402010 countsByYear W23214020102017 @default.
• W2321402010 countsByYear W23214020102018 @default.
• W2321402010 countsByYear W23214020102019 @default.
• W2321402010 countsByYear W23214020102022 @default.
• W2321402010 countsByYear W23214020102023 @default.
• W2321402010 crossrefType "journal-article" @default.
• W2321402010 hasAuthorship W2321402010A5017769947 @default.
• W2321402010 hasAuthorship W2321402010A5039810933 @default.
• W2321402010 hasAuthorship W2321402010A5040320969 @default.
• W2321402010 hasConcept C121332964 @default.
• W2321402010 hasConcept C130188946 @default.
• W2321402010 hasConcept C144024400 @default.
• W2321402010 hasConcept C145148216 @default.
• W2321402010 hasConcept C147192597 @default.
• W2321402010 hasConcept C147597530 @default.
• W2321402010 hasConcept C149923435 @default.
• W2321402010 hasConcept C152365726 @default.
• W2321402010 hasConcept C178790620 @default.
• W2321402010 hasConcept C183971685 @default.
• W2321402010 hasConcept C184779094 @default.
• W2321402010 hasConcept C185592680 @default.
• W2321402010 hasConcept C18705241 @default.
• W2321402010 hasConcept C198291218 @default.
• W2321402010 hasConcept C2781442258 @default.
• W2321402010 hasConcept C2908647359 @default.
• W2321402010 hasConcept C32909587 @default.
• W2321402010 hasConcept C41999313 @default.
• W2321402010 hasConcept C4839761 @default.
• W2321402010 hasConcept C62520636 @default.
• W2321402010 hasConceptScore W2321402010C121332964 @default.
• W2321402010 hasConceptScore W2321402010C130188946 @default.
• W2321402010 hasConceptScore W2321402010C144024400 @default.
• W2321402010 hasConceptScore W2321402010C145148216 @default.
• W2321402010 hasConceptScore W2321402010C147192597 @default.
• W2321402010 hasConceptScore W2321402010C147597530 @default.
• W2321402010 hasConceptScore W2321402010C149923435 @default.
• W2321402010 hasConceptScore W2321402010C152365726 @default.
• W2321402010 hasConceptScore W2321402010C178790620 @default.
• W2321402010 hasConceptScore W2321402010C183971685 @default.

• next