Total angular momentum of water molecule and its interaction with a constant magnetic field
DOI:
https://doi.org/10.31349/RevMexFis.70.050401Keywords:
Water molecule; total angular momentum; energy levels; quantum mechanics; magnetic resonance imagingAbstract
The water molecule has many biological functions and is one of the most abundant molecules in the human body. Then, in order to carry out a study of the molecule in physical and chemical phenomena, the model used depends on the phenomenon. For some cases, it is necessary to consider the electronic distribution, while in other cases, it is necessary to consider the protons of the hydrogen atoms, for example, to explain the physics in magnetic resonance imaging. In this work, the water molecule model considered is conformed by three particles: The two nuclei of the hydrogen atom and the oxygen atom negatively double charged and unstructured. The spatial wave function and the interaction of the angular momentum of protons with a constant magnetic field has been studied in a previous work. The present work is a completion, in order to have the complete wave function of this model, considering the spin of the protons, where the energy is degenerated (B = 0). Finally, the interaction of the spin of the nuclei of hydrogen atoms with a magnetic field is studied, representing the case of magnetic resonance imaging, where it is obtained a break in the degeneration of the energy levels, which are in the order of radiofrequency.
References
I. Plante, A review of simulation codes and approaches for radiation chemistry, Phys. Med. Biol. 66 (2021) 03TR02, https://iopscience.iop.org/article/10.1088/1361-6560/abbd19
J. P. Ridgway, Cardiovascular magnetic resonance physics for clinicians: part I, J. Cardiovasc. Magn. Reson. 12 (2010) 71, https://doi.org/10.1186/1532-429X-12-71
Y. Gossuin et al., Physics of magnetic resonance imaging: from spin to pixel, J. Phys. D: Appl. Phys. 43 (2010) 213001, https://dx.doi.org/10.1088/0022-3727/43/21/213001
S. Izadi et al., Building Water Models: A Different Approach, J. Phys. Chem. Lett. 5 (2014) 3863, https://doi.org/10.1021/jz501780a
S. Incerti et al., Comparison of GEANT4 very low energy cross section models with experimental data in water, Med. Phys. 37 (2010) 4692, https://aapm.onlinelibrary.wiley.com/doi/abs/10.1118/1.3476457
M. A. Bernal et al., Track structure modeling in liquid water: A review of the Geant4-DNA very low energy extension of the Geant4 Monte Carlosimulation toolkit, Physica Medica. 31 (2015) 861, https://doi.org/10.1016/j.ejmp.2015.10.087
B. Mascialino et al., New Developments of the Goodnessof-Fit Statistical Toolkit, IEEE Transactions on Nuclear Science. 53 (2006) 3834, https://ieeexplore.ieee.org/document/4033685
R. McWeeny and K. A. Ohno, A Quantum-Mechanical Study of the Water Moleule, Proc. R. Soc. Lond. A. 255 (1960) 1282, https://doi.org/10.1098/rspa.1960.0072
H. F. Schaefer III and C. F. Bender, Multiconfiguration Wavefunctions for the Water Molecule, J. Chem. Phys. 55 (1971) 1720, https://aip.scitation.org/doi/10.1063/1.1676302
MRI Mayo Clinic, https://www.mayoclinic.org/tests-procedures/mri/about/pac-20384768
Web MD. https://www.webmd.com/a-to-z-guides/what-is-an-mri
Medical News Today https://www.medicalnewstoday.com/articles/146309
J. Zhang, G. Shim, S. M. de Toledo and E. I. Azzam, The Translationally Controlled Tumor Protein and the Cellular Response to Ionizing Radiation- Induced DNA Damage, In: A. Telerman and R. Amson (eds.) TCTP/tpt1 - Remodeling Signaling from Stem Cell to Disease, Results and Problems in Cell Differentiation, vol. 64 (Springer, Cham., 2017), https://doi.org/10.1007/978-3-319-67591-612
R. A. Pooley, Fundamental Physics of MR Imaging, The AAPM/RSNA physics tutorial for residents, 25 (2005) 1087, https://doi.org/10.1148/rg.254055027
A. Pai, R. Shetty and Y. S. Chowdhury, Magnetic Resonance Imaging Physics, Stat Pearls (2021). https://www.ncbi.nlm.nih.gov/books/NBK564320/
V. S. Vassiliouetal et al., Magnetic resonance imaging: Physics basics for the cardiologist, JRSM Cardiovascular Dis. 7 (2018) 1, https://doi.org/10.1177/2048004018772237
S. D. Serai et al., Components of a magnetic resonance imaging system and their relationship to safety and image quality, Pediatr. Radiol. 51 (2021) 716, https://doi.org/10.1007/s00247-020-04894-9
S. S. Zumdahl, Water (Encyclopedia Britannica, 2021). https://www.britannica.com/science/water
C. H. Zepeda Fernandez ´ et al., Proton wave function in a water molecule: Breakdown of degeneration caused by interactions with the magnetic field of a Magnetic Resonance Imaging device, Rev. Mex. Fis. 68 (2022) 3, https://doi.org/10.31349/RevMexFis.68.031101
CODATA values of the fundamental constants. NIST. https://www.nist.gov/programsprojects/codata-values-fundamental-physical-constants
B. Pastina, and J. A. La Verne, Effect of Molecular Hydrogen on Hydrogen Peroxide in Water Radiolysis, J. Phys. Chem. A. 105 (2001) 9316, https://doi.org/10.1021/jp012245j
D. Feller, C. M. Boyle and E. R. Davidson, One-electron properties of several small molecules using near Hartree-Fock limit basis sets, J. Chem. Phys. 86 (1987) 3424, https://doi.org/10.1063/1.451999
B. K. Clark et al., Computing the energy of a water molecule using MultiDeterminants: A simple, efficient algorithm, J. Chem. Phys., 135 (2011) 244105, https://doi.org/10.1063/1.3665391
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