Johan Hörnquist, Patrik Hedvall, Ann E. Orel, Åsa Larson
{"title":"H++H -和H(1<mml:mi…","authors":"Johan Hörnquist, Patrik Hedvall, Ann E. Orel, Åsa Larson","doi":"10.1103/physreva.108.052811","DOIUrl":null,"url":null,"abstract":"Associative ionization in collisions of ${\\mathrm{H}}^{+}+{\\mathrm{H}}^{\\ensuremath{-}}$ as well as $\\mathrm{H}(1s)+\\mathrm{H}(ns)$ with $n=2,3,4$ is studied theoretically. Relevant adiabatic potential curves and nonadiabatic couplings are calculated ab initio and the autoionization from the lowest electronic resonant states in the ${}^{1}{\\mathrm{\\ensuremath{\\Sigma}}}_{g/u}^{+}$ and ${}^{3}{\\mathrm{\\ensuremath{\\Sigma}}}_{g/u}^{+}$ symmetries are considered. The cross sections are obtained by solving the coupled Schr\\\"odinger equation, including a complex potential matrix, in a strict diabatic representation. The importance of using a nonlocal description of autoionization is investigated. Associative ionization is also studied for different isotopes of hydrogen. Calculated cross sections are compared with results from measurements.","PeriodicalId":20121,"journal":{"name":"Physical Review","volume":"11 6","pages":"0"},"PeriodicalIF":0.0000,"publicationDate":"2023-11-13","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":"{\"title\":\"Associative ionization in collisions of H++H− and H(1<mml:mi…\",\"authors\":\"Johan Hörnquist, Patrik Hedvall, Ann E. Orel, Åsa Larson\",\"doi\":\"10.1103/physreva.108.052811\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"Associative ionization in collisions of ${\\\\mathrm{H}}^{+}+{\\\\mathrm{H}}^{\\\\ensuremath{-}}$ as well as $\\\\mathrm{H}(1s)+\\\\mathrm{H}(ns)$ with $n=2,3,4$ is studied theoretically. Relevant adiabatic potential curves and nonadiabatic couplings are calculated ab initio and the autoionization from the lowest electronic resonant states in the ${}^{1}{\\\\mathrm{\\\\ensuremath{\\\\Sigma}}}_{g/u}^{+}$ and ${}^{3}{\\\\mathrm{\\\\ensuremath{\\\\Sigma}}}_{g/u}^{+}$ symmetries are considered. The cross sections are obtained by solving the coupled Schr\\\\\\\"odinger equation, including a complex potential matrix, in a strict diabatic representation. The importance of using a nonlocal description of autoionization is investigated. Associative ionization is also studied for different isotopes of hydrogen. Calculated cross sections are compared with results from measurements.\",\"PeriodicalId\":20121,\"journal\":{\"name\":\"Physical Review\",\"volume\":\"11 6\",\"pages\":\"0\"},\"PeriodicalIF\":0.0000,\"publicationDate\":\"2023-11-13\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Physical Review\",\"FirstCategoryId\":\"1085\",\"ListUrlMain\":\"https://doi.org/10.1103/physreva.108.052811\",\"RegionNum\":0,\"RegionCategory\":null,\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"\",\"JCRName\":\"\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Physical Review","FirstCategoryId":"1085","ListUrlMain":"https://doi.org/10.1103/physreva.108.052811","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"","JCRName":"","Score":null,"Total":0}
Associative ionization in collisions of H++H− and H(1
Associative ionization in collisions of ${\mathrm{H}}^{+}+{\mathrm{H}}^{\ensuremath{-}}$ as well as $\mathrm{H}(1s)+\mathrm{H}(ns)$ with $n=2,3,4$ is studied theoretically. Relevant adiabatic potential curves and nonadiabatic couplings are calculated ab initio and the autoionization from the lowest electronic resonant states in the ${}^{1}{\mathrm{\ensuremath{\Sigma}}}_{g/u}^{+}$ and ${}^{3}{\mathrm{\ensuremath{\Sigma}}}_{g/u}^{+}$ symmetries are considered. The cross sections are obtained by solving the coupled Schr\"odinger equation, including a complex potential matrix, in a strict diabatic representation. The importance of using a nonlocal description of autoionization is investigated. Associative ionization is also studied for different isotopes of hydrogen. Calculated cross sections are compared with results from measurements.