Writing up UFT267

July 30, 2014

The logical way to write this up is to start with the classical lagrangian analysis of any three dimensional orbit and to prove that any three dimensional orbit can be analysed in terms of two elliptical orbits, one for theta and one for phi, then proceed to the quantum theory of these two ellipses (x theory with x = 1). The mathematical format of the classical analysis is the same for gravitation and electrostatics. The quantum theory is based directly on the classical theory with p psi = – i h bar del psi. Expectation values of r are then computed for various orbitals of atomic hydrogen and the results are wholly original. The expectation values for the theta ellipse are completely different from those of the phi ellipse and can be used to characterize any material in computational quantum mechanics. Both sets of expectation values of r, <r>, depend on the ellipticity. Then proceed to the effects of ubiquitous Thomas precession. These are relativistic corrections which can be compared to the results of the fermion equation in future work, following a suggestion by Dr. Horst Eckardt. The earlier notes will be referred to in the text and posted as usual.

Faulty Routers

July 30, 2014

I am not sure why these faulty routers do not allow access to www.aias.us but allow access to the other ECE sites: www.atomicprecision.com, www.upitec.org and the archives at the British Library www.webarchive.org.uk. They also seem to allow access to the blog, on which all the new papers are posted. Your translation and broadcasting work is indeed very valuable, and as you can see has created a permanent readership throughout the Spanish and Portuguese speaking world, especially your translation of Lar Felker’s book. The blog is in English and Welsh but even so has a following in 171 countries, including every country of the mainland Americas with the exception of one Guyana country. Almost all of the Caribbean is also represented on the blog feedback. They speak very good Welsh in Patagonia as you know. Many of the papers are also read intensely around the world in Spanish. This shows that if the sites were translated into the main languages they would probably triple their readership at a rough guess. This would be especially true of countries with different alphabets.

To: EMyrone@aol.com
Sent: 29/07/2014 17:59:08 GMT Daylight Time
Subj: Re: Networks in Mexico that can access http://www.aias.us

My carrier is in fact prodigy-infinitum, and I have already talked to them although I doubt they will do something to fix this, since they hold a quasi monopoly on internet services, similar to your AOL situation. Fortunately, my email works well, and I get emails with new papers from you which I translate and send to Dave for posting. I can still visit the AIAS website through the alternate websites, although these are not updated as is the AIAS website. A way around this is to download a VPN, which should enable my computer to use a different route to the aias website. I traced the problem and it seems to be located in Mexico City, in one or more of prodigy´s routers, so I am not sure the VN will do the job, since the router is too close to my terminal.

Regards,

PS Re: 267(5).

July 30, 2014

This is an interesting idea. As you know the fermion equation was greatly developed recently using your code, giving many new spectral effects. The factor x is certainly relativistic in nature.

To: EMyrone@aol.com
Sent: 29/07/2014 15:29:16 GMT Daylight Time
Subj: PS Re: 267(5): Effect of Ubiquitous Thomas Precession on the Schroedinger Equation

PS: perhaps the angular momentum correction can be compared to the relativistic corrections in the Fermion equation.

EMyrone@aol.com hat am 29. Juli 2014 um 11:51 geschrieben:

This note shows that the effect is to make the ellipse of note 267(4) precess, with precession factor given by Eq. (11). The Schroedinger equation is changed to Eq. (26), which appears to be insoluble analytically but can be approximated by Eq. (38) which gives Schroedinger solutions with k replaced by x squared k wherever k occurs in the wavefunctions (k = e squared / (4 pi eps0)), so e squared can be coded in as x squared e squared. The precession factor x is very close to unity as in planetary precession, but spectral techniques are very precise and might be able to observe its effects. The expectation values are defined in Eq. (40) and have to be worked out nmerically as in Note 267(4). The ubiquitous Thomas precession changes the entire subject of computational quantum chemistry. It is caused by a rotating Minkowski metric. The rotation in this case is that of the electron around the proton in an H atom. In planetary precession it is the rotation of m around M. In pendulum precession it is the rotation of the earth’s surface. It is not the Thomas factor of a half, which is already factored in to the fermion equation, it is ubiquitous, and appears for example in pendulum precessions, planetary orbits and now it has been realized to exist in atomic and molecular spectra. As usual this is a simple first theory that can be greatly refined.

Discussion 267(5)

July 30, 2014

Many thanks again! Agreed about eqs. (7) and (12). To be accurate of course Eq. (26) has to be solved numerically or analytically to find the effect on the energy levels of H and to detect splitting of spectral lines, if any, due to ubiquitous Thomas precession. There is an extra L squared operator:

L squared psi = l(l+1) h bar squared psi

and this may well lead to spectral splitting. As you infer this is an interesting effect.

To: EMyrone@aol.com
Sent: 29/07/2014 15:27:45 GMT Daylight Time
Subj: Re: 267(5): Effect of Ubiquitous Thomas Precession on the Schroedinger Equation

It seems that eq.(7) should read

MG –> k/m = hbar c alpha_f / m

but (11) is correct.
EQ. (25) seems to define a correction to the angular momentum. This appears at the LHS when the delta operator is rewritten to spherical coordinates. I am not sure if this results in a simple correction x^2 L^2 ananlogues to x^2 k.

Horst

EMyrone@aol.com hat am 29. Juli 2014 um 11:51 geschrieben:

This note shows that the effect is to make the ellipse of note 267(4) precess, with precession factor given by Eq. (11). The Schroedinger equation is changed to Eq. (26), which appears to be insoluble analytically but can be approximated by Eq. (38) which gives Schroedinger solutions with k replaced by x squared k wherever k occurs in the wavefunctions (k = e squared / (4 pi eps0)), so e squared can be coded in as x squared e squared. The precession factor x is very close to unity as in planetary precession, but spectral techniques are very precise and might be able to observe its effects. The expectation values are defined in Eq. (40) and have to be worked out nmerically as in Note 267(4). The ubiquitous Thomas precession changes the entire subject of computational quantum chemistry. It is caused by a rotating Minkowski metric. The rotation in this case is that of the electron around the proton in an H atom. In planetary precession it is the rotation of m around M. In pendulum precession it is the rotation of the earth’s surface. It is not the Thomas factor of a half, which is already factored in to the fermion equation, it is ubiquitous, and appears for example in pendulum precessions, planetary orbits and now it has been realized to exist in atomic and molecular spectra. As usual this is a simple first theory that can be greatly refined.

Daily Report 27-28/7/14 (Partial)

July 30, 2014

A timer bug caused the loss of most data but for these two days there were 956 hits from 290 distinct visits recorded. Main spiders from google, MSN, yandex and yahoo. Essay 25 Fallacy of Indeterminacy 964, Auto1 336, Auto2 92, F3(Sp) 173, Essay 25(Sp) 166, UFT88 108, UFT177(Sp) 97, UFT177 84, Crisis in Cosmology 80, Llais 65, CEFE 47, Engineering Model 46, UFT264 40, Book of Scientometrics 77, Principles of ECE 23, Evans Equations 50 (est) numeous Spanish, Englynion 30 (est) to date in July 2014. Data Foundry Inc. UFT88.

Usage Statistics for aias.us aias.us

Summary Period: July 2014 – URL
Generated 29-Jul-2014 10:37 EDT

List of European Countries in Order of Diary Interest

July 29, 2014

This list is: Britain, Germany, France, Sweden, Italy, Netherlands, Denmark, Spain, Switzerland, Austria, Russian Federation, Ireland, Poland, Portugal, Belgium, Norway, Finland, Czechia, Romania, Greece, Hungary, Serbia, Ukraine, Croatia, Slovakia, Bulgaria, Lithuania, Aland Islands, Luxembourg. Estonia, Albania, Cyprus, Iceland, Latvia, Malta, Macedonia, Belarus, Jersey, Moldova, San Marino, Guernsey, Isle of Man, Montenegro, Faroe Islands, Gibraltar and Liechtenstein. The only country not to have visited is Andorra, which may use a Spanish or French system. There have been diary visits from 171 of the world’s 193 countries and territories. The three leading countries are Britain, United States and Canada. The blog is kindly backed up by Michael Jackson and is archived at the British Library from the National Library of Wales. Many thanks to all who helped to construct it. Culture can unify nearly all the countries of the world, in this case science, history, genealogy, poetry and prose, and occasional postings of art. In the past four years the interest in the diary has almost tripled. It is a private diary like Kilvert’s diary of my ancestral village of Cleirwy or Clyro in Powys, just across the river from Hay on Wye. The readings of the diary have reached over a quarter million since 1/1/10. The main ECE sites have been read an estimated forty million times plus since 2002.

List of Spanish and Portuguese Speaking Countries

July 29, 2014

In order of interest in this www.aias.us blog or diary these are: Brazil, Spain, Portugal, Mexico, Argentina, Chile, Peru, Colombia, Venezuela, Guatemala, Uruguay, Dominican Republic, Costa Rica, Puerto Rico, Bolivia, Guyana, Panama, Dominica, Nicaragua, El Salvador, Paraguay.

Orbitals with Ubiquitous Thomas Precession

July 29, 2014

These results are full of interest again, and there may be a way of testing for them experimentally. Dirac’s advice was to develop a theory with imagination to see if it gave sensible results and then refine it. Of course these are first theoretical attempts capable of great development with supercomputers and code libraries. Since IBM MOTECC was produced in 1988 there has been a proliferation of code packages and libraries, many suitable for desktops. Clementi hired me for the second time in 1988 to be the MOTECC lead writer, and this produced the lead article of the entire MOTEC series, Omnia Opera 289. He also let me use the IBM 3096 and 3084. Both Clementi and myself have been nominated for Nobel Prizes. He was an IBM Fellow before he retired and the other visiting professor at IBM Kingston from 1986 to 1987 was Clement Roothaan of the Roothaan equations. He was Clementi’s Ph. D. supervisor. My first wife and I were then hired at Cornell Theory Center which was funded by IBM. It had its own IBM 3096 and its own array processor. I also worked at ETH from Univ. Zuerich also on an IBM 3096. All the code is archived on www.aias.us and at the British Library. It was double precision FORTRAN from single precision 128 bit CDC 7600. All my code is in pristine condition back to 1971 and of course works now. The proof is the prize winning animation with Chris Pelkie on www.aias.us. It should easily have won first prize in the IBM supercomputer competition but B(3) was too much of a shock, too many notes, too much imagination, so it got honorable mention. Chris put a huge effort into it and was very disappointed. He need not have been because the same work has been nominated several times for a Nobel Prize.

To: EMyrone@aol.com
Sent: 29/07/2014 12:55:39 GMT Daylight Time
Subj: Re: Discussion Part 3 on Note 267(4)

I quickly computed the expectation values of velocity and radius for the Schrödinger orbitals with x factor precession in the elliptic orbit. The veliocities do not change. for the azimutal orbit the result is (for all quantum numbers as before):

For the theta orbit the integrals are not solvable analytically.

Horst

EMyrone@aol.com hat am 29. Juli 2014 um 12:23 geschrieben:

I have heard that the penguins are taking up geometry, have nothing else to do in mid winter Antarctica. The general code is indeed very useful. The chain of reasoning is that the Bohr atom is described completely by a circular limit of an elliptical orbit, the circle being a cut through the spherical Bohr orbitals, (S orbitals of the Schroedinger atom). The expectation values of r in one of the planes of the ellipse give the Bohr radii corrected with an epsilon dependent parameter. The planar orbit gives a cut through the orbitals. In order to get the energy levels of H the ellipticity must vanish so that the phi cut gives the Bohr radii. It is well known that the Schroedinger atom gives the Bohr radii. The key point is that the Bohr theory emerges if and only if the starting conical section is an ellipse, whose ellipticity is made to vanish. The vanishing ellipticity gives the energy levels both for Bohr and Schroedinger hydrogen. So the most basic function is the conical section. There is also your type of quantization where x = n. The expectation values of this type of function would also give very interesting results.

To: EMyrone@aol.com
Sent: 29/07/2014 08:25:11 GMT Daylight Time
Subj: Re: Computational results from 267(4): Velocities and Expectation Values of r

So it was fruitful that I did the calculations last night :-) Nice to hear that the calculations meanwhile are “world famous”. It pays off that I prepared the code for papers 250/251 in a general way, I only had to define some new operators and evaluate the pre-defined integrals.
It will be highly interesting how these results are related to x theory. ECE has already made the transition between classical theory and quantum mechanics much closer and clearer, the new development makes it even very ostensive.

Horst

EMyrone@aol.com hat am 29. Juli 2014 um 08:06 geschrieben:

Yes, just to be totally confusing the two books use different notation and in the final UFT267 the notation used in previous papers can be used to avoid this confusion. These results are full of interest as usual. The most fascinating result to me is that the expectation values for the phi plane are all the same, for every orbital, and are each corrected for ellipticity by the same factor. For circular Bohr orbitals this factor is unity. However the classical hamiltonian gives a two dimensional ellipse, not a circle, and the quantum results must also be based on the ellipse. Even more accurately it must be a precessing ellipse of x theory and going in to that will be my next task. In the theta plane the results are completely different as you show. Nothing like this appears in any of the textbook literature on the Schroedinger equation. So by a scholarly inspection of the fundamentals a very large amount of completely new results comes out very often in many UFT papers. By now Horst has the code set up in entirety for the H atom and for each calculation the Born normalization is checked and found to be correct. An orbital of H is three dimensional, but the hamiltonian gives a two dimensional ellipse which must be embedded in three dimensions as discussed here. There are an infinite number of ways of doing this, and the computation gives results from the theta plane and phi plane. These are completely different sets of results, unloading a huge amount of new results on an unsuspecting world. So there is a lot more to the hydrogen atom than ever dreamed of. A new subject area of computational quantum chemistry is

opened up for exploration by these results. Although H looks complicated it is in fact peanuts for contemporary computational quantum chemistry, which can handle DNA and superstructures of molecules and so on. This type of result will appear for every atom and molecule and in general across all of computational quantum chemistry. This was the Clementi group speciality at IBM Kingston in the mid eighties, using experimental array processing and supercomputers. Today’s desktops can crunch out a tremendous amount of new data very quickly, as Horst shows here So supercomputers and code packages can be used now for this type of information that will characterize all atoms and molecules. So it looks as if x theory is a goldmine of new information in all directions, as of course is ECE theory.

Sent: 28/07/2014 21:36:24 GMT Daylight Time
Subj: Re: 267(4): Expectation Values of r

I have to remark first that the Vector Analysis Problem Solver denotes the angles just inversely compared to the standard denomination in quantum chemistry which is used by Atkins. In the latter, phi is the azimuth angle and appears in form of terms exp(i m phi). I highly recommed to keep this definition because we used it in earlier papers and my code is based on this.
We have two possibilities of symmetrically placing the elliptic orbits in a 3D coordinate system: in the phi plane and in the theta plane. The results of both are given in the attached program output. Placing the ellipse in the phi plane gives the result you obtained. Since the phi factor in the spherical harmonics is always the same, the result is independent of the (l,m) quantum numbers, as comes out from the calculation.
Putting the ellipse into the theta plane gives quite different results. They now depend on the quantum numbers and give logarithmic expressions, indenpendent of principal quantum number n, because the spherical harmonics do not depend on n.

Horst

Am 28.07.2014 13:29, schrieb EMyrone

This note gives the expectation values of r from x and Schroedinger quantization. The results are different from Bohr theory in general and it will be very interesting to calculate them for higher order orbitals by computer algebra, using code adapted from pervious UFT papers.

267(6): Lagrangian Analysis of Three Dimensional Orbits

July 29, 2014

In this note it is shown that any three dimensional orbit can be described in terms of two ellipses, Eqs. (8) and (19), one for theta and one for phi, and two Binet and Leibniz equations, i.e. the three dimensional orbit can be factorized into two planar orbits. These are exactly the same as the two ellipses used in the computations by co author Horst Eckardt in note 267(4). So I think I am now ready to write up my sections of UFT267. For the H atom the two ellipses give a rich variety of new results for the H atom, and so this method is generally applicable in computational quantum chemistry for any material: atomic, molecular, polymeric, colloidal and so forth; semiconductors, superconductors, and any system in which computational quantum chemistry can be applied, from Debye Hueckel to ab initio.

a267thpapernotes6.pdf

Discussion Part 3 on Note 267(4)

July 29, 2014

I have heard that the penguins are taking up geometry, have nothing else to do in mid winter Antarctica. The general code is indeed very useful. The chain of reasoning is that the Bohr atom is described completely by a circular limit of an elliptical orbit, the circle being a cut through the spherical Bohr orbitals, (S orbitals of the Schroedinger atom). The expectation values of r in one of the planes of the ellipse give the Bohr radii corrected with an epsilon dependent parameter. The planar orbit gives a cut through the orbitals. In order to get the energy levels of H the ellipticity must vanish so that the phi cut gives the Bohr radii. It is well known that the Schroedinger atom gives the Bohr radii. The key point is that the Bohr theory emerges if and only if the starting conical section is an ellipse, whose ellipticity is made to vanish. The vanishing ellipticity gives the energy levels both for Bohr and Schroedinger hydrogen. So the most basic function is the conical section. There is also your type of quantization where x = n. The expectation values of this type of function would also give very interesting results.

To: EMyrone@aol.com
Sent: 29/07/2014 08:25:11 GMT Daylight Time
Subj: Re: Computational results from 267(4): Velocities and Expectation Values of r

So it was fruitful that I did the calculations last night :-) Nice to hear that the calculations meanwhile are “world famous”. It pays off that I prepared the code for papers 250/251 in a general way, I only had to define some new operators and evaluate the pre-defined integrals.
It will be highly interesting how these results are related to x theory. ECE has already made the transition between classical theory and quantum mechanics much closer and clearer, the new development makes it even very ostensive.

Horst

EMyrone@aol.com hat am 29. Juli 2014 um 08:06 geschrieben:

Yes, just to be totally confusing the two books use different notation and in the final UFT267 the notation used in previous papers can be used to avoid this confusion. These results are full of interest as usual. The most fascinating result to me is that the expectation values for the phi plane are all the same, for every orbital, and are each corrected for ellipticity by the same factor. For circular Bohr orbitals this factor is unity. However the classical hamiltonian gives a two dimensional ellipse, not a circle, and the quantum results must also be based on the ellipse. Even more accurately it must be a precessing ellipse of x theory and going in to that will be my next task. In the theta plane the results are completely different as you show. Nothing like this appears in any of the textbook literature on the Schroedinger equation. So by a scholarly inspection of the fundamentals a very large amount of completely new results comes out very often in many UFT papers. By now Horst has the code set up in entirety for the H atom and for each calculation the Born normalization is checked and found to be correct. An orbital of H is three dimensional, but the hamiltonian gives a two dimensional ellipse which must be embedded in three dimensions as discussed here. There are an infinite number of ways of doing this, and the computation gives results from the theta plane and phi plane. These are completely different sets of results, unloading a huge amount of new results on an unsuspecting world. So there is a lot more to the hydrogen atom than ever dreamed of. A new subject area of computational quantum chemistry is opened up for exploration by these results. Although H looks complicated it is in fact peanuts for contemporary computational quantum chemistry, which can handle DNA and superstructures of molecules and so on. This type of result will appear for every atom and molecule and in general across all of computational quantum chemistry. This was the Clementi group speciality at IBM Kingston in the mid eighties, using experimental array processing and supercomputers. Today’s desktops can crunch out a tremendous amount of new data very quickly, as Horst shows here So supercomputers and code packages can be used now for this type of information that will characterize all atoms and molecules. So it looks as if x theory is a goldmine of new information in all directions, as of course is ECE theory.

Sent: 28/07/2014 21:36:24 GMT Daylight Time
Subj: Re: 267(4): Expectation Values of r

I have to remark first that the Vector Analysis Problem Solver denotes the angles just inversely compared to the standard denomination in quantum chemistry which is used by Atkins. In the latter, phi is the azimuth angle and appears in form of terms exp(i m phi). I highly recommed to keep this definition because we used it in earlier papers and my code is based on this.
We have two possibilities of symmetrically placing the elliptic orbits in a 3D coordinate system: in the phi plane and in the theta plane. The results of both are given in the attached program output. Placing the ellipse in the phi plane gives the result you obtained. Since the phi factor in the spherical harmonics is always the same, the result is independent of the (l,m) quantum numbers, as comes out from the calculation.
Putting the ellipse into the theta plane gives quite different results. They now depend on the quantum numbers and give logarithmic expressions, indenpendent of principal quantum number n, because the spherical harmonics do not depend on n.

Horst

Am 28.07.2014 13:29, schrieb EMyrone

This note gives the expectation values of r from x and Schroedinger quantization. The results are different from Bohr theory in general and it will be very interesting to calculate them for higher order orbitals by computer algebra, using code adapted from pervious UFT papers.


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