Response to Geoffrey Neuss on how to teach the 4s and 3d orbital conundrum

Scerri Eric

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Response to Geoffrey Neuss on how to teach the 4s and 3d orbital conundrum

机译：对Geoffrey Neuss的回应如何教导4S和3D轨道难题

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In the accompanying article in this issue Neuss challenges the explanation that was first suggested by Schwarz for how to teach the relative occupation and ionization of atomic orbitals in the atoms of metals in the first transition series. The present article is a response to Neuss' critique which includes a detailed examination of his claim that there is no conclusive evidence for the view that the scandium and other first transition metal atoms lose 4s electrons in preference to those located in 3d orbitals.

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《Foundations of chemistry》 |2021年第2期|共5页
作者
Scerri Eric;
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作者单位

Univ Calif Los Angeles Dept Chem &

Biochem Los Angeles CA 90095 USA;

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原文格式 PDF
正文语种 eng
中图分类化学;
关键词
Aufbau; Electronic configurations; Orbital energies; Scandium atom; Transition metals;

机译：Aufbau;电子配置;轨道能量;钪原子;过渡金属;

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1. Use of combined Hartree–Fock–Roothaan theory in evaluation of lowest states of K[Ar]4s 03d 1 and Cr + [Ar]4s 03d 5 isoelectronic series over noninteger n-Slater type orbitals [J] . I I GUSEINOV, M ERTURK, E SAHIN Pramana . 2011,第1期

机译：结合Hartree-Fock-Roothaan理论在评估K [Ar] 4s 0 3d 1 和Cr + [Ar] 4s 0 3d 5 < / sup>非整数n-Slater型轨道上的等电子序列
2. Use of combined Hartreea€“Focka€“Roothaan theory in evaluation of lowest states of $K[Ar]4s^0 3d^1$ and $Cr^+ [Ar]4s^0 3d^5$ isoelectronic series over noninteger e?‘?-Slater type orbitals [J] . E Sahin, I I Guseinov1, M Erturk Pramana . 2011,第1期

机译：在非整数e上使用结合的Hartreea“ Focka” Roothaan理论评估$ K [Ar] 4s ^ 0 3d ^ 1 $和$ Cr ^ + [Ar] 4s ^ 0 3d ^ 5 $等电子序列的最低态吗？ '？-平板型轨道
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机译：TICL +（3）δ（3D4S）-X-3-PHI（3D（2））可视系统的激光速度调制光谱和自旋轨道结构的表征
4. DFH-4S PLATFORM DEVELOPMENT AND IN-ORBIT FLIGHT [C] . Min Wang, Zhicheng Zhou, Feng Li, International astronautical congress . 2016

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5. PART I. THEORETICAL TRANSITION-PROBABILITIES FOR THE (2P ODD-PI-ORBITAL)-(1S EVEN-SIGMA-ORBITAL) AND (2P ODD-PI-ORBITAL)-(3D EVEN-SIGMA-ORBITAL) TRANSITION IN SINGLY POSITIVEMOLECULAR HYDROGEN ION. PART II. POSSIBLE SINGLY POSITIVE MOLECULAR HYDROGEN ION ULTRAVIOLET EMISSION-SPECTRUM FROM JUPITER. [D] . WU, FUN-MIN -1

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6. Calculated Line Strengths for the Transition Array (3d3 + 3d2 4s)− 3d2 4p in Ti ii [O] . H. Mendlowitz 1969

机译：Ti ii中过渡阵列（3d3 + 3d2 4s）− 3d2 4p的计算线强度
7. Use of Combined Hartree-Fock-Roothaan Theory in Evaluation of Lowest States of K [Ar]4s^0 3d^1 and Cr+ [Ar]4s^0 3d^5 Isoelectronic Series Over Noninteger n-Slater Type Orbitals [O] . Guseinov, I. I., Erturk, M., Sahin, E. 2008

机译：Hartree-Fock-Roothaan组合理论在最低评价中的应用状态K [ar] 4s ^ 0 3d ^ 1和Cr + [ar] 4s ^ 0 3d ^ 5等电子系列非整数n-slater型轨道
8. Kinetic Spectroscopy in the Far Vacuum Ultraviolet. Part 5. Oscillator Strengths for the 3s, 4s, 5s, 3d and 4d4P(j)-2p3 4S3/2 superscript 0 Transitions in Atomic Nitrogen [R] . Clyne, M. A. A., Jaffe, S., Whitefield, P. D. 1979

机译：远真空紫外光谱中的动力学光谱。第5部分。原子氮中3s，4s，5s，3d和4d4p（j）-2p3 4s3 / 2上标0跃迁的振子强度

Response to Geoffrey Neuss on how to teach the 4s and 3d orbital conundrum

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