Abstract
The spin torque, the zeta force, and the zeta potential, which are significant quantities to describe the local picture of spin dynamics, are studied by using allene-type molecules (C3H4 and C3H2Li2) in their stationary states. We show that the two molecules have different distribution patterns of these quantities though their structures are very similar to each other. It is also shown that the zeta potential distribution is almost independent of the electron density distribution.
Access this chapter
Tax calculation will be finalised at checkout
Purchases are for personal use only
References
Tachibana A (2001) J Chem Phys 115:3497
Tachibana A (2003) In: Brändas EJ, Kryachko ES (eds) Fundamental world of quantum chemistry, a tribute to the memory of Per-Olov Löwdin, vol 2. Kluwer Academic, Dordrecht, p 211
Tachibana A (2005) J Mol Model 11:301
Tachibana A (2010) J Mol Struct, Theochem 943:138
Doi K, Nakamura K, Tachibana A (2006) In: International workshop on nano CMOS. IEEE Press, New York, pp 209–235
Doi K, Mikazuki Y, Sugino S, Doi T, Szarek P, Senami M, Shiraishi K, Iwai H, Umezawa N, Chikyo T, Yamada K, Tachibana A (2008) Jpn J Appl Phys 47:205
Szarek P (2008) PhD dissertation, Kyoto University
Fukushima A, Tsuchida Y, Senami M, Tachibana A (2010) Jpn J Appl Phys 49:111504
Fukushima A, Sugino S, Tsuchida Y, Senami M, Tachibana A (2010) Jpn J Appl Phys 49:121504
Senami M, Tsuchida Y, Fukushima A, Ikeda Y, Tachibana A (2012) Jpn J Appl Phys 51:031101
Senami M, Ikeda Y, Fukushima A, Tachibana A (2010) Jpn J Appl Phys 49:115002
Senami M, Ikeda Y, Tachibana A (2011) Jpn J Appl Phys 50:010103
Senami M, Ikeda Y, Tachibana A (2012) AIP Adv 2:042168.
Senami M, Ikeda Y, Tachibana A (2013) To be pulished in J Phys Conf Ser
Senami M, Nishikawa J, Hara T, Tachibana A (2010) J Phys Soc Jpn 79:084302
Hara T, Senami M, Tachibana A (2012) Phys Lett A 376:1434
Szarek P, Tachibana A (2007) J Mol Model 13:651
Szarek P, Sueda Y, Tachibana A (2008) J Chem Phys 129:94102
Szarek P, Urakami K, Zhou C, Cheng H, Tachibana A (2009) J Chem Phys 130:084111
Tachibana A (2001) J Chem Phys 115:3497
Tachibana A (2003) In: Brändas E, Kryachko E (eds) Fundamental perspectives in quantum chemistry: a tribute to the memory of Per-Olov Löwdin, vol 2. Kluwer Academic, Dordrecht, pp 211–239
Tachibana A (2004) Int J Quant Chem 100:981
Messiah A (1961) Quantum mechanics. North-Holland, New York
Sakurai JJ (1967) Advanced quantum mechanics. Addison-Wesley, Reading
DIRAC, a relativistic ab initio electronic structure program, Release DIRAC11 (2011), written by R. Bast, H. J. Aa. Jensen, T. Saue, and L. Visscher, with contributions from V. Bakken, K. G. Dyall, S. Dubillard, U. Ekström, E. Eliav, T. Enevoldsen, T. Fleig, O. Fossgaard, A. S. P. Gomes, T. Helgaker, J. K. Lærdahl, J. Henriksson, M. Iliaš, Ch. R. Jacob, S. Knecht, C. V. Larsen, H. S. Nataraj, P. Norman, G. Olejniczak, J. Olsen, J. K. Pedersen, M. Pernpointner, K. Ruud, P. Sałek, B. Schimmelpfennig, J. Sikkema, A. J. Thorvaldsen, J. Thyssen, J. van Stralen, S. Villaume, O. Visser, T. Winther, and S. Yamamoto (see http://dirac.chem.vu.nl)
Dunning TH Jr (1989) J Chem Phys 90:1007
Saue T, Fægri K, Helgaker T, Gropen O (1997) Mol Phys 91:937
Senami M, Ichikawa K, Tachibana A, QEDynamics (http://www.tachibana.kues.kyoto-u.ac.jp/qed)
Ichikawa K, Fukuda M, Tachibana A (2012) Int J Quant Chem 113:190
Senami M, Miyazato T, Takada S, Ikeda Y, Tachibana A (2013) To be published in J Phys Conf Ser
Acknowledgements
This work was partially supported by a Grant-in-Aid for Scientific Research from the Japan Society for the Promotion of Science (JSPS) (22550011). M.S. is supported by a Grant-in-Aid for Young Scientists (B) from JSPS (24760028) and Mizuho Foundation for the Promotion of Sciences.
Author information
Authors and Affiliations
Corresponding author
Editor information
Editors and Affiliations
Rights and permissions
Copyright information
© 2013 Springer International Publishing Switzerland
About this paper
Cite this paper
Fukuda, M., Senami, M., Tachibana, A. (2013). Spin Torque and Zeta Force in Allene-Type Molecules. In: Hotokka, M., Brändas, E., Maruani, J., Delgado-Barrio, G. (eds) Advances in Quantum Methods and Applications in Chemistry, Physics, and Biology. Progress in Theoretical Chemistry and Physics, vol 27. Springer, Cham. https://doi.org/10.1007/978-3-319-01529-3_7
Download citation
DOI: https://doi.org/10.1007/978-3-319-01529-3_7
Publisher Name: Springer, Cham
Print ISBN: 978-3-319-01528-6
Online ISBN: 978-3-319-01529-3
eBook Packages: Chemistry and Materials ScienceChemistry and Material Science (R0)