We present an improved Born-Oppenheimer method for the treatment of molecules. Our development is based on taking into account a portion of the kinetic energy which was inadvertently omitted by Born and Oppenheimer. Our theory replaces the set of standard atom-atom potentials by an evolution operator. In particular, in contrast to the traditional Born-Oppenheimer method our amended basis describes the so-called Wannier phenomenon which deforms potential surfaces, and traps one or more threshold electrons into an unstable equilibrium. Within our framework that trapping manifests itself as a Fresnel distribution. Finally we discover a π/2 phase jump in the evolution operator caused by the diffraction of a two-electron wave from a potential ridge.

/pdf/the-born-oppenheimer-approximation-revisited-4n1yibvova.pdf

The Born-Oppenheimer Approximation Revisited

Es ist ein gesichertes und in weiten Kreisen bekanntes Ergebnis der Atom- und Molekulartheorie, das die Molekule chemischer Stoffe aus Atomen aufgebaut sind.

Physikalisch-chemische Grundlagen biologischer Vorgänge

The problem of spin manipulation via the spin-orbit interaction in nonmagnetic semiconductors in the absence of magnetic fields is investigated in this work. We begin with a review of the literature on spin dynamics in semiconductors, then discuss the semi-empirical k · p method of calculating direct-gap semiconductor properties, which we use to estimate material parameters significant for manipulation of spin even in the absence of a magnetic field. The total effective magnetic fields and precession lengths are calculated for a variety of quantum well orientations, and a class of devices are proposed that will allow for all-electric arbitrary manipulation of spin orientations. The strainand momentum-dependent spin splitting coefficient C3 has been calculated using a fourteen band Kane k ·p model for a variety of III-V semiconductors as well as ZnSe and CdSe. It is observed that the spin-splitting parameters C3 and γ, corresponding to the strain-induced spin-orbit interaction and Dresselhaus coefficient, are sensitive to the value of the inter-band spin-orbit coupling ∆− between the p valence and p̄ second conduction band in all cases. The value of ∆− has therefore been recalculated in these materials using a tight-binding model and modern experimental values of the valence and second conduction band spin-orbit splittings. The total effective magnetic field and precession length of spins in strained quantum wells in the (001), (110), and (111) planes are derived with consideration for all known effective magnetic fields except those due to interface effects in noncommon-atom heterostructures (native inversion asymmetry). The orientation of the k-linear Dresselhaus field and the strain-dependent fields vary strongly with the growth axis of the quantum well. The precession length in the (110) and (001) cases can achieve infinite anisotropy, while the precession length of (111) quantum wells is

https://ir.uiowa.edu/cgi/viewcontent.cgi?article=3411&context=etd

Spin transport in strained non-magnetic zinc blende semiconductors

Ableitung des Planckschen Strahlungsgesetzes für Atome mit zwei Freiheitsgraden

Science is a process, through which theoretical frameworks are developed, new phenomena defined and discovered, and properties of entities tested. The goal of this dissertation is to illustrate how high-energy physics exemplified the process of theory construction from the 1950s to 1970s, and the promising ways in which it can continue to do so today. The lessons learned from the case studies examined here can inform future physics, and may provide methodological clues as to the best way forward today. I examine the discovery of parity nonconservation in weak interactions, the emergence of Yang-Mills theories as the foundation of the standard model, and contemporary precision testing of quantum electrodynamics. In each of these cases, I examine the details of the physicists’ practice to draw conclusions regarding the epistemology behind successful episodes of theory construction. I reconstruct the methodology of each episode in order to find generalizable lessons to apply to contemporary issues at the frontiers of the search for a theory of quantum gravity. In order to understand the many moving parts in each case study, I introduce a new terminology to distinguish the “parts” of a scientific discipline, inspired by the literature on scientific modelling. These terms—theoretical framework, dynamical model, phenomenological model, experiment, and mathematical tools—are meant to aid in investigating other quantitative scientific disciplines beyond high-energy physics. Ultimately, high-energy physics is at its best when various avenues of theoretical ideas are being pursued, spurring the development of new mathematical techniques to use as tools, and new ideas are quickly and vigorously tested experimentally. Proliferation of new ideas in response to theoretical developments is characteristic of the era of construction of the standard model, and is still ongoing in precision testing of quantum electrodynamics today.

/pdf/theory-construction-in-high-energy-particle-physics-16lhvumf10.pdf

Theory construction in high-energy particle physics

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The Born-Oppenheimer Approximation Revisited

Physikalisch-chemische Grundlagen biologischer Vorgänge

Spin transport in strained non-magnetic zinc blende semiconductors

Ableitung des Planckschen Strahlungsgesetzes für Atome mit zwei Freiheitsgraden

Theory construction in high-energy particle physics

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