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首页> 外文期刊>International Journal of Quantum Chemistry >Ritz variational method for the high‐lying nonautoionizing doubly excited 1,31,3 FF e ee states of two‐electron atoms
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Ritz variational method for the high‐lying nonautoionizing doubly excited 1,31,3 FF e ee states of two‐electron atoms

机译：RITZ变分方法对于高躺线的非丁香化双重激发 1,3 1,3 f f e 两个电子原子的e

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Abstract > Energy eigenvalues of nonautoionizing doubly excited <mat:math display="inline" altimg="urn:x-wiley:00207608:media:qua25577:qua25577-math-0002" wiley:location="equation/qua25577-math-0002.png"> <mat:mrow> <mat:msup> <mat:mrow/> <mat:mrow> <mat:mn>1</mat:mn> <mat:mo>,</mat:mo> <mat:mn>3</mat:mn> </mat:mrow> </mat:msup> <mat:msup> <mat:mi>F</mat:mi> <mat:mi>e</mat:mi> </mat:msup> </mat:mrow> </mat:math> states originating from 2pnf ( <mat:math display="inline" altimg="urn:x-wiley:00207608:media:qua25577:qua25577-math-0003" wiley:location="equation/qua25577-math-0003.png"> <mat:mrow> <mat:mi>n</mat:mi> <mat:mo>=</mat:mo> <mat:mn>4</mat:mn> <mat:mo>?</mat:mo> <mat:mn>20</mat:mn> </mat:mrow> </mat:math> ) configuration of two‐electron atoms <mat:math display="inline" altimg="urn:x-wiley:00207608:media:qua25577:qua25577-math-0004" wiley:location="equation/qua25577-math-0004.png"> <mat:mrow> <mat:mi>Z</mat:mi> <mat:mo>=</mat:mo> <mat:mn>3</mat:mn> <mat:mo>?</mat:mo> <mat:mn>18</mat:mn> </mat:mrow> </mat:math> have been calculated by expanding the basis set in explicitly correlated Hylleraas coordinates under the framework of Ritz variational method. A detailed discussion on the evaluation of correlated basis integrals is given. The energy eigenvalues of a number of these doubly excited states are being reported for the first time especially for the high lying states. The effective quantum numbers ( <mat:math di </span> <span class="z_kbtn z_kbtnclass hoverxs" style="display: none;">展开▼</span> </div> <div class="translation abstracttxt"> <span class="zhankaihshouqi fivelineshidden" id="abstract"> <span>机译：</span><Abstract Type =“main”XML：Lang =“en”> <标题类型=“main”>抽象</ title> > undutionizing的能量特征值倍为兴奋<mat：math显示=“内联”Altimg =“URN ：X-Wiley：00207608：媒体：QUA25577：QUA25577-Math-0002“Wiley：Location =”等式/ Qua25577-Math-0002.png“> <MAT：MROW> <MAT：MSUP> <MAT：MROW /> < MAT：MROW> <MAT：MN> 1 </ MAT：MN> <MAT：MO>，</ MAT：MO> <MAT：Mn> 3 </ MAT：Mn> </ MAT：MROW> </ MAT： msup> <mat：msup> <mat：mi> f </ mat：mi> <mat：mi> e </ mat：mi> </ mat：msup> </ mat：mrow> </ mat：math>状态源自2PNF（<MAT：MATH DISPLAY =“内联”ALTIMG =“URN：X-WIley：00207608：媒体：QUA25577：QUA25577-MATH-0003”WIley：Location =“等式/ QUA25577-MATH-0003.PNG”> <MAT：MROW> <MAT：MI> N </ MAT：MI> <MAT：MO> = </ MAT： MO> <MAT：Mn> 4 </ MAT：Mn> <MAT：MO>α？</ MO：MO> <MAT：MN> 20 </ MAT：MN> </ MAT：MROW> </ MAT：MATH> ）两电子原子的配置<mat：数学显示=“内联”Altimg =“URN：X-Wiley：00207608：媒体：Qua25577：Qua25577-Math-0004”Wiley：Location =“等式/ QUA25577-Math-0004。 PNG“> <MAT：MROW> <MAT：MI> Z </ MAT：MI> <MAT：MO> = </ MAT：MO> <MAT：MN> 3 </ MAT：MN> <MAT：MO>？ </ mat：<mo> <mat：Mn> 18 </ mat：Mn> </ mat：MROW> </ MAT：数学>已经通过在Ritz变分方法框架下扩大了明确相关的Hylleraas坐标中的基础集的计算。给出了关于相关基础积分的评估的详细讨论。尤其是对于高位撒谎的国家首次报告了许多双重激发态的能量特征值。有效量子数（<mat：math di </span> <span class="z_kbtn z_kbtnclass hoverxs" style="display: none;">展开▼</span> </div> </div> <div class="record"> <h2 class="all_title" id="enpatent33" >著录项</h2> <ul> <li> <span class="lefttit">来源</span> <div style="width: 86%;vertical-align: text-top;display: inline-block;"> <a href='/journal-foreign-21753/'>《International Journal of Quantum Chemistry》</a> <b style="margin: 0 2px;">|</b><span>2018年第14期</span><b style="margin: 0 2px;">|</b><span>共18页</span> </div> </li> <li> <div class="author"> <span class="lefttit">作者</span> <p id="fAuthorthree" class="threelineshidden zhankaihshouqi"> <a href="/search.html?doctypes=4_5_6_1-0_4-0_1_2_3_7_9&sertext=Dutta Sayantan&option=202" target="_blank" rel="nofollow">Dutta Sayantan;</a> <a href="/search.html?doctypes=4_5_6_1-0_4-0_1_2_3_7_9&sertext=Sil Amar N.&option=202" target="_blank" rel="nofollow">Sil Amar N.;</a> <a href="/search.html?doctypes=4_5_6_1-0_4-0_1_2_3_7_9&sertext=Saha Jayanta K.&option=202" target="_blank" rel="nofollow">Saha Jayanta K.;</a> <a href="/search.html?doctypes=4_5_6_1-0_4-0_1_2_3_7_9&sertext=Mukherjee Tapan K.&option=202" target="_blank" rel="nofollow">Mukherjee Tapan K.;</a> </p> <span class="z_kbtnclass z_kbtnclassall hoverxs" id="zkzz" style="display: none;">展开▼</span> </div> </li> <li> <div style="display: flex;"> <span class="lefttit">作者单位</span> <div style="position: relative;margin-left: 3px;max-width: 639px;"> <div class="threelineshidden zhankaihshouqi" id="fOrgthree"> <p>Belgharia Texmaco Estate SchoolBelgharia Kolkata 700056 India;</p> <p>Department of PhysicsJogamaya Devi CollegeKolkata 700026 India;</p> <p>Department of PhysicsAliah University IIA/27Newtown Kolkata 700156 India;</p> <p>Department of PhysicsNarula Institute of TechnologyAgarpara Kolkata 700109 India;</p> </div> <span class="z_kbtnclass z_kbtnclassall hoverxs" id="zhdw" style="display: none;">展开▼</span> </div> </div> </li> <li > <span class="lefttit">收录信息</span> <span style="width: 86%;vertical-align: text-top;display: inline-block;"></span> </li> <li> <span class="lefttit">原文格式</span> <span>PDF</span> </li> <li> <span class="lefttit">正文语种</span> <span>eng</span> </li> <li> <span class="lefttit">中图分类</span> <span><a href="https://www.zhangqiaokeyan.com/clc/1186.html" title="物理化学（理论化学）、化学物理学">物理化学（理论化学）、化学物理学;</a></span> </li> <li class="antistop"> <span class="lefttit">关键词</span> <p style="width: 86%;vertical-align: text-top;"> <a style="color: #3E7FEB;" href="/search.html?doctypes=4_5_6_1-0_4-0_1_2_3_7_9&sertext=doubly excited states&option=203" rel="nofollow">doubly excited states;</a> <a style="color: #3E7FEB;" href="/search.html?doctypes=4_5_6_1-0_4-0_1_2_3_7_9&sertext=Hylleraas coordinates&option=203" rel="nofollow">Hylleraas coordinates;</a> <a style="color: #3E7FEB;" href="/search.html?doctypes=4_5_6_1-0_4-0_1_2_3_7_9&sertext=two‐electron atoms&option=203" rel="nofollow">two‐electron atoms;</a> <a style="color: #3E7FEB;" href="/search.html?doctypes=4_5_6_1-0_4-0_1_2_3_7_9&sertext=variational method&option=203" rel="nofollow">variational method;</a> </p> <div class="translation"> 机译：双重兴奋状态;Hylleraas坐标;双电子原子;变分方法; 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