Academic literature on the topic 'Free energy perturbation theory'
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Journal articles on the topic "Free energy perturbation theory"
Mon, K. K. "Lower free energy bound for hard-sphere perturbation theory." Journal of Chemical Physics 116, no. 21 (June 2002): 9392–94. http://dx.doi.org/10.1063/1.1472507.
Full textKalikmanov, V. I., R. Hagmeijer, and C. H. Venner. "Statistical Mechanical Perturbation Theory of Solid–Vapor Interfacial Free Energy." Journal of Physical Chemistry C 121, no. 12 (March 17, 2017): 6868–73. http://dx.doi.org/10.1021/acs.jpcc.7b01331.
Full textVilseck, Jonah Z., Julian Tirado-Rives, and William L. Jorgensen. "Determination of partial molar volumes from free energy perturbation theory." Physical Chemistry Chemical Physics 17, no. 13 (2015): 8407–15. http://dx.doi.org/10.1039/c4cp05304d.
Full textTopor, Nadia. "Perturbation Method for Boundary S-Matrix in 2D Quantum Field Theory." Modern Physics Letters A 12, no. 38 (December 14, 1997): 2951–62. http://dx.doi.org/10.1142/s0217732397003071.
Full textPERIWAL, VIPUL. "FREE ENERGY DECREASES ALONG WILSON RENORMALIZATION GROUP TRAJECTORIES." Modern Physics Letters A 10, no. 21 (July 10, 1995): 1543–48. http://dx.doi.org/10.1142/s0217732395001666.
Full textTobias, Douglas J., and Charles L. Brooks. "Calculation of free energy surfaces using the methods of thermodynamic perturbation theory." Chemical Physics Letters 142, no. 6 (December 1987): 472–76. http://dx.doi.org/10.1016/0009-2614(87)80646-2.
Full textNieto, Agustin. "Perturbative QCD at High Temperature." International Journal of Modern Physics A 12, no. 08 (March 30, 1997): 1431–64. http://dx.doi.org/10.1142/s0217751x97001043.
Full textABE, MITSUO, and NOBORU NAKANISHI. "NONRENORMALIZABILITY MAY BE SUPERFICIAL IN THE COVARIANT FORMALISM OF QUANTUM GRAVITY." Modern Physics Letters A 10, no. 21 (July 10, 1995): 1501–6. http://dx.doi.org/10.1142/s0217732395001629.
Full textMA, BO-QIANG, and JI SUN. "NEW SCALING VARIABLE FROM LIGHT-CONE PERTURBATION THEORY." International Journal of Modern Physics A 06, no. 03 (January 30, 1991): 345–63. http://dx.doi.org/10.1142/s0217751x91000216.
Full textGreeff, C. W. "Tests of Monte Carlo perturbation theory for the free energy of liquid copper." Journal of Chemical Physics 128, no. 18 (May 14, 2008): 184104. http://dx.doi.org/10.1063/1.2917355.
Full textDissertations / Theses on the topic "Free energy perturbation theory"
Lowis, D. R. "Application of theoretical methods to the study of small molecules in solution." Thesis, University of Oxford, 1994. http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.240696.
Full textKing, Paul M. "Application of free energy perturbation calculations to molecular biophysics." Thesis, University of Oxford, 1990. http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.257951.
Full textJames, Richard. "Applications of perturbation theory in high energy electron diffraction." Thesis, University of Bath, 1990. https://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.235789.
Full textJackson, Brendan Marc. "Modelling dark energy." Thesis, University of Edinburgh, 2011. http://hdl.handle.net/1842/5763.
Full textHollenstein, Lukas. "Applications of Cosmological Perturbation Theory to Dynamical Dark Energy and Primordial Magnetogenesis." Thesis, University of Portsmouth, 2009. http://ethos.bl.uk/OrderDetails.do?uin=uk.bl.ethos.508870.
Full textMasango, Senamile Khethekile Ntombizothando. "Measuring transitional matrix elements using first-order perturbation theory in Coulomb excitation." University of the Western Cape, 2019. http://hdl.handle.net/11394/6704.
Full textThe aim of nuclear structure physics is to study the interplay between singleparticle and collective degrees of freedom in nuclei and to explain how nuclei get excited and decay under di erent external conditions, such as strong electric and magnetic elds. If nuclei absorb a large amount of energy and angular momentum, like in a scattering reaction when you bombard a target that is in the ground state with a projectile at high bombarding energies, the energy from the projectile gets transfered to the target and vice versa, hence both projectile and target may get excited. During the de-excitation process nuclei may release the energy in a form of electromagnetic radiation (gamma rays) which carries angular momentum. The atomic nucleus is a many-body system, whose structure is de ned in terms of interactions between protons and neutrons. In nature there are only around 300 stable isotopes [1]. They are all in their ground states (although some are in a low-energy excited isomeric state with a long lifetime). To study excited states in these nuclei one needs to provide energy to the system. In addition, there are some 3000 unstable nuclei, most of which do not exist in nature. Many have been produced and studied in research laboratories, and there could be more than 3000 other unstable nuclei that can in principle exist in astrophysical environments, but have not yet been synthesized on Earth [1].
FREIRE, LUCAS. "RENEWABLE ENERGY COMMERCIALIZATION MODEL FOR THE FREE MARKET VIA COOPERATIVE GAMES THEORY." PONTIFÍCIA UNIVERSIDADE CATÓLICA DO RIO DE JANEIRO, 2013. http://www.maxwell.vrac.puc-rio.br/Busca_etds.php?strSecao=resultado&nrSeq=22134@1.
Full textCONSELHO NACIONAL DE DESENVOLVIMENTO CIENTÍFICO E TECNOLÓGICO
No Brasil, as três principais fontes renováveis de energia elétrica são eólica, pequenas centrais hidrelétricas (PCHs) e biomassa. A comercialização da energia proveniente dessas fontes ocorre majoritariamente no ambiente de contratação regulada (ACR), através de leilões, em detrimento do ambiente de contratação livre (ACL). Isso devido ao fato de seus recursos naturais serem sazonais, estabelecendo o risco de preço-quantidade no ACL, em que o excesso ou déficit de energia gerada em relação à quantidade contratada é liquidado ao preço de liquidação de diferenças (PLD), uma variável sistêmica e altamente volátil. Contudo, a complementaridade dessas fontes permite reduzir esses riscos quando a energia é comercializada de forma conjunta, através de um fundo de energia que gera aumento do valor do portfólio com relação à comercialização individual. Esta dissertação utiliza a teoria de jogos cooperativos para analisar formas de repartir o benefício gerado, através da alocação de quotas financeiras. O conjunto de soluções onde o resultado individual das fontes no fundo é maior do que o resultado individual em qualquer subcoalisão define o núcleo do jogo. Assim, a complexidade de encontrar uma solução dentro do núcleo depende do número de subcoalizões, que cresce exponencialmente com o número de jogadores. Nesse contexto, este trabalho se propôs a apresentar: (i) um modelo de portfólio que incentiva a participação de fontes renováveis no ACL; (ii) um modelo de programação linear que busca o núcleo do jogo; (iii) uma metodologia eficiente baseada em decomposição de Benders, capaz de suprimir a questão da explosão combinatória do problema.
In Brazil, the three main sources of renewable energy are wind, small run-of-river hidros (SH) and biomass. The energy sale of such sources occurs mainly in the Regulated Trading Environment (RTE), through auctions, with shy occurrences in the Free Trading Environment (FTE). This is due to the fact that their natural resources are seasonal, establishing the so-called price-quantity risk in the FTE, as the surplus or deficit of energy generated relative to the contracted amount is settled at the market’s spot price, a systemic and highly volatile variable. However, the complementary nature of these sources allows risk reduction if their energy are trade jointly, through an energy hedge pool that increases the value of the portfolio in comparison to individual strategies. This work makes use of cooperative games theory to analyze ways of sharing the generated benefit, through financial quotas allocation. The set of solutions where the individual sources results in the pool are greater than its results at any possible subcoalition defines the core of the game. Thus, the challenge of finding a solution inside the core depends on the number of subcoalitions, which grows exponentially with the number of players. In this context, this work proposes to present: (i) a model of portfolio that encourages the penetration of renewable sources in the FTE; (ii) a linear programming model that pursuits the game’s core; (iii) an efficient methodology based on Benders decomposition that is capable of suppress the problem of combinatorial explosion, typical of cooperative games with many players.
Pearson, Jonathan Andrew. "Generalized perturbations in modified gravity and dark energy." Thesis, University of Manchester, 2012. https://www.research.manchester.ac.uk/portal/en/theses/generalized-perturbations-in-modified-gravity-and-dark-energy(ac520c15-f240-4c63-84af-1110fdfc9815).html.
Full textKeränen, Henrik. "Advances in Ligand Binding Predictions using Molecular Dynamics Simulations." Doctoral thesis, Uppsala universitet, Beräknings- och systembiologi, 2014. http://urn.kb.se/resolve?urn=urn:nbn:se:uu:diva-230777.
Full textItoh, Kazuhito, and Masaki Sasai. "Multidimensional theory of protein folding." American Institite of Physics, 2009. http://hdl.handle.net/2237/12626.
Full textBooks on the topic "Free energy perturbation theory"
Mills, Randell L. The grand unified theory. Ephrata, Pennsylvania: Science Press, 1990.
Find full textKing, Moray B. Quest for zero point energy: Engineering principles for "free energy" inventions. Kempton, Ill: Adventures Unlimited, 2001.
Find full textUnification of spacetime, the forces, matter, and energy. Ephrata, Pennsylvania: Science Press, 1992.
Find full textMezhdunarodnyĭ simpozium "Neodnorodnye ėlektronnye sostoi͡anii͡a" (5th 1995? Novosibirsk, Russia?). Pi͡atyĭ Mezhdunarodnyĭ simpozium "Neodnorodnye ėlektronnye sostoi͡anii͡a": Tezisy dokladov, 12-14 senti͡abri͡a. Novosibirsk: In-t neorganicheskoĭ khimii Sibirskogo otd-nie RAN, 1995.
Find full textA, Boi͡arskiĭ L., Nauchnyĭ sovet po probleme "Fizika nizkikh temperatur" (Akademii͡a nauk SSSR), and Institut neorganicheskoĭ khimii (Akademii͡a nauk SSSR), eds. Tretiĭ Vsesoi͡uznyĭ simpozium "Neodnorodnye ėlektronnye sostoi͡anii͡a": Tezisy dokladov, 21-23 noi͡abri͡a. Novosibirsk: [s.n.], 1989.
Find full textA, Boi͡arskiĭ L., Nauchnyĭ sovet po probleme "Fizika nizkikh temperatur" (Akademii͡a nauk SSSR), and Institut neorganicheskoĭ khimii (Akademii͡a nauk SSSR), eds. Chetvertyĭ Vsesoi͡uznyĭ simpozium "Neodnorodnye ėlektronnye sostoi͡anii͡a": Tezisy dokladov, 4-6 marta. Novosibirsk: In-t neorganicheskoĭ khimii SO AN SSSR, 1991.
Find full textDawson, Donald Andrew. Large deviations, free energy functional and quasi-potential for a mean field model of interacting diffusions. Providence, R.I., USA: American Mathematical Society, 1989.
Find full textR, Haydock, Inglesfield J. E. 1945-, and Pendry J. B, eds. Bonding and structure of solids: Proceedings of a Royal Society Discussion Meeting, held on 20 and 21 September 1990. London: The Society, 1991.
Find full textF, Mott N. Electronic processes in non-crystalline materials. 2nd ed. Oxford: Clarendon Press, 2012.
Find full textConduction in non-crystalline materials. Oxford: Clarendon Press, 1987.
Find full textBook chapters on the topic "Free energy perturbation theory"
Chipot, Christophe, and Andrew Pohorille. "Calculating Free Energy Differences Using Perturbation Theory." In Springer Series in CHEMICAL PHYSICS, 33–75. Berlin, Heidelberg: Springer Berlin Heidelberg, 2007. http://dx.doi.org/10.1007/978-3-540-38448-9_2.
Full textDrukarev, Evgeny G., and Aleksandr I. Mikhailov. "Perturbation Theory." In High-Energy Atomic Physics, 25–50. Cham: Springer International Publishing, 2016. http://dx.doi.org/10.1007/978-3-319-32736-5_3.
Full textStingl, M. "An Extended Perturbation Theory for QCD." In Contemporary Topics in Medium Energy Physics, 63–76. Boston, MA: Springer US, 1994. http://dx.doi.org/10.1007/978-1-4757-9835-7_6.
Full textStanton, Robert V., Steven L. Dixon, and Kenneth M. Merz. "Free Energy Perturbation Calculations Within Quantum Mechanical Methodologies." In ACS Symposium Series, 142–53. Washington, DC: American Chemical Society, 1996. http://dx.doi.org/10.1021/bk-1996-0629.ch010.
Full textStanton, Robert V., Steven L. Dixon, and Kenneth M. Merz. "Free Energy Perturbation Calculations within Quantum Mechanical Methodologies." In Computational Approaches to Biochemical Reactivity, 103–23. Dordrecht: Springer Netherlands, 2002. http://dx.doi.org/10.1007/0-306-46934-0_2.
Full textBarnett, B. L., and Cathleen B. Turner. "Free Energy Perturbation Techniques Applied To Subtilisin BPN’ Stability." In Advances in Experimental Medicine and Biology, 121–31. Boston, MA: Springer US, 1996. http://dx.doi.org/10.1007/978-1-4613-0319-0_13.
Full textEisenman, George, Osvaldo Alvarez, and Johan Aqvist. "Free Energy Perturbation Simulations of Cation Binding to Valinomycin." In The Pedersen Memorial Issue, 23–53. Dordrecht: Springer Netherlands, 1992. http://dx.doi.org/10.1007/978-94-011-2532-1_3.
Full textHuang, Ji-Ping. "Temperature Trapping Theory: Energy-Free Thermostat." In Theoretical Thermotics, 107–17. Singapore: Springer Singapore, 2020. http://dx.doi.org/10.1007/978-981-15-2301-4_10.
Full textWu, Duo, and Lai-jun Liu. "Bridge damage pattern identification based on perturbation theory." In Advances in Energy Science and Equipment Engineering II, 455–59. Taylor & Francis Group, 6000 Broken Sound Parkway NW, Suite 300, Boca Raton, FL 33487-2742: CRC Press, 2017. http://dx.doi.org/10.1201/9781315116167-90.
Full textRoy, Dipankar, and Andriy Kovalenko. "CHAPTER 6. Solvation Free Energy by 3D-RISM-KH Theory." In Gibbs Energy and Helmholtz Energy, 227–37. Cambridge: Royal Society of Chemistry, 2021. http://dx.doi.org/10.1039/9781839164095-00227.
Full textConference papers on the topic "Free energy perturbation theory"
ANDERSEN, JENS O. "THREE LOOP FREE ENERGY USING SCREENED PERTURBATION THEORY." In Proceedings of the SEWM2000 Meeting. WORLD SCIENTIFIC, 2001. http://dx.doi.org/10.1142/9789812799913_0013.
Full textVaroto, Paulo S., and Andreza T. Mineto. "Nonlinear Dynamics of Piezoelectric Cantilever Energy Converters Through Perturbation Theory and Experimental Analysis." In ASME 2014 International Design Engineering Technical Conferences and Computers and Information in Engineering Conference. American Society of Mechanical Engineers, 2014. http://dx.doi.org/10.1115/detc2014-34744.
Full textPascual-Gutie´rrez, Jose´ A., Jayathi Y. Murthy, and Raymond Viskanta. "Thermal Conductivity and Phonon Transport Properties of Silicon Using Perturbation Theory and the Environment-Dependent Interatomic Potential." In ASME 2009 International Mechanical Engineering Congress and Exposition. ASMEDC, 2009. http://dx.doi.org/10.1115/imece2009-12934.
Full textRossikhin, Yury A., Marina V. Shitikova, and Viktor V. Shitikov. "Shock Interaction in Thermoelastic Rods With Temperature and Strain Coupling." In ASME 2012 International Mechanical Engineering Congress and Exposition. American Society of Mechanical Engineers, 2012. http://dx.doi.org/10.1115/imece2012-87350.
Full textGómez Nicola, A. "Thermal Meson properties within Chiral Perturbation Theory." In HADRON PHYSICS: Effective Theories of Low Energy QCD Second International Workshop on Hadron Physics. AIP, 2003. http://dx.doi.org/10.1063/1.1570568.
Full textNicola, Angel Gómez. "Nonequilibrium chiral perturbation theory and disoriented chiral condensates." In The international workshop on hadron physics of low energy QCD. AIP, 2000. http://dx.doi.org/10.1063/1.1303025.
Full textLu, C. X., C. C. Wang, C. K. Sung, and Paul C. P. Chao. "Dynamic Analysis of a Motion Transformer Mimicking a Hula Hoop." In ASME 2009 International Design Engineering Technical Conferences and Computers and Information in Engineering Conference. ASMEDC, 2009. http://dx.doi.org/10.1115/detc2009-86378.
Full textBar, Oliver, and Sinya Aoki. "Determining the low energy parameters of Wilson Chiral Perturbation Theory." In XXIIIrd International Symposium on Lattice Field Theory. Trieste, Italy: Sissa Medialab, 2005. http://dx.doi.org/10.22323/1.020.0046.
Full textMaas, Axel. "Accessing the properties of the elementary Higgs beyond perturbation theory." In 35th International Conference of High Energy Physics. Trieste, Italy: Sissa Medialab, 2011. http://dx.doi.org/10.22323/1.120.0375.
Full textEnemark, Søren, and Ilmar F. Santos. "Dynamic Interaction Between Rotor and Axially-Magnetized Passive Magnetic Bearing Considering Magnetic Eccentricity." In ASME 2014 International Mechanical Engineering Congress and Exposition. American Society of Mechanical Engineers, 2014. http://dx.doi.org/10.1115/imece2014-38032.
Full textReports on the topic "Free energy perturbation theory"
Forest, E. Hamiltonian-free perturbation theory: The concept of phase advance. Office of Scientific and Technical Information (OSTI), February 1987. http://dx.doi.org/10.2172/6733115.
Full textHo, L. Lawrence, P. A. Bash, and A. D. ,. Jr Kerell. Proton and hydride transfers in solution: hybrid QMmm/MM free energy perturbation study. Office of Scientific and Technical Information (OSTI), March 1996. http://dx.doi.org/10.2172/207038.
Full textWilliams, Hayes L., Betsy M. Rice, and Cary F. Chabalowski. Investigation of the CH3CN-CO2 Potential Energy Surface (PES) Using Symmetry-Adapted Perturbation Theory (SAPT). Fort Belvoir, VA: Defense Technical Information Center, September 2000. http://dx.doi.org/10.21236/ada383319.
Full textPreitschopf, Christian Richard. Two Exercises in Supersymmetry: A Low-Energy Supergravity Model and Free String Field Theory. Office of Scientific and Technical Information (OSTI), June 2018. http://dx.doi.org/10.2172/1454020.
Full textPreitschopf, C. R. Two exercises in supersymmetry: a low-energy supergravity model and free string field theory. Office of Scientific and Technical Information (OSTI), September 1986. http://dx.doi.org/10.2172/5213163.
Full textAntonsen, T. M. Jr, W. W. Destler, V. Granatstein, and B. Levush. Microwave generation for magnetic fusion energy applications. Task A, Free electron lasers with small period wigglers; Task B, Theory and modeling of high frequency, high power gyrotron operation: Progress report, May 1, 1993--May 1, 1994. Office of Scientific and Technical Information (OSTI), May 1994. http://dx.doi.org/10.2172/10151962.
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