Result Number | Material Type | Add to My Shelf Action | Record Details and Options |
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1 |
Material Type: Artigo
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Equation of state for thermodynamic properties of chain fluids near-to and far-from the vapor–liquid critical regionJiang, Jianwen ; Prausnitz, John M.The Journal of chemical physics, 1999-10, Vol.111 (13), p.5964-5974 [Periódico revisado por pares]Texto completo disponível |
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2 |
Material Type: Artigo
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Ab initio study of the hydroxide ion-water clusters An accurate determination of the thermodynamic properties for the processes n`H IND. 2´O+O`H POT. -´`seta´ H`O POT. -´`(`H IND. 2´O) IND. n´(n=1-4)Josefredo R Pliego Júnior José Manuel RiverosJournal of Chemical Physics New York v. 112, n. 9, p. 4045-4052, 2000New York 2000Item não circula. Consulte sua biblioteca.(Acessar) |
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3 |
Material Type: Artigo
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Ab initio study of the hydroxide ion-water clusters An accurate determination of the thermodynamic properties for the processes n`H IND. 2´O+O`H POT. -´`seta´ H`O POT. -´`(`H IND. 2´O) IND. n´(n=1-4)Josefredo R Pliego Júnior José Manuel RiverosJournal of Chemical Physics New York v. 112, n. 9, p. 4045-4052, 2000New York 2000Item não circula. Consulte sua biblioteca.(Acessar) |
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4 |
Material Type: Artigo
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Correlational and thermodynamic properties of finite-temperature electron liquids in the hypernetted-chain approximationTanaka, ShigenoriThe Journal of chemical physics, 2016-12, Vol.145 (21), p.214104-214104 [Periódico revisado por pares]United States: American Institute of PhysicsTexto completo disponível |
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5 |
Material Type: Artigo
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Incorporating a completely renormalized coupled cluster approach into a composite method for thermodynamic properties and reaction pathsNedd, Sean A. ; DeYonker, Nathan J. ; Wilson, Angela K. ; Piecuch, Piotr ; Gordon, Mark S.The Journal of chemical physics, 2012-04, Vol.136 (14), p.144109-144109-13 [Periódico revisado por pares]United States: American Institute of PhysicsTexto completo disponível |
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6 |
Material Type: Artigo
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Dependence of a cooling rate on structural and vibrational properties of amorphous silicon: A neural network potential-based molecular dynamics studyLi, Wenwen ; Ando, YasunobuThe Journal of chemical physics, 2019-09, Vol.151 (11) [Periódico revisado por pares]Melville: American Institute of PhysicsTexto completo disponível |
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7 |
Material Type: Artigo
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Thermodynamic properties of mixtures of dipolar and quadrupolar hard spheres: Theory and simulationJiang, Shaoyi ; Pitzer, Kenneth S.The Journal of chemical physics, 1995-05, Vol.102 (19), p.7632-7640 [Periódico revisado por pares]Texto completo disponível |
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8 |
Material Type: Artigo
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Thermodynamic properties of sulfurhexafluoride in the critical regionWyczalkowska, A. Kostrowicka ; Sengers, J. V.The Journal of chemical physics, 1999-07, Vol.111 (4), p.1551-1560 [Periódico revisado por pares]Texto completo disponível |
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9 |
Material Type: Artigo
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Guidelines for creating artificial neural network empirical interatomic potential from first-principles molecular dynamics data under specific conditions and its application to α-Ag2SeShimamura, Kohei ; Fukushima, Shogo ; Koura, Akihide ; Shimojo, Fuyuki ; Misawa, Masaaki ; Kalia, Rajiv K. ; Nakano, Aiichiro ; Vashishta, Priya ; Matsubara, Takashi ; Tanaka, ShigenoriThe Journal of chemical physics, 2019-09, Vol.151 (12) [Periódico revisado por pares]Melville: American Institute of PhysicsTexto completo disponível |
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10 |
Material Type: Artigo
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Molecular dynamics study on condensation/evaporation coefficients of chain molecules at liquid-vapor interfaceNagayama, Gyoko ; Takematsu, Masaki ; Mizuguchi, Hirotaka ; Tsuruta, TakaharuThe Journal of chemical physics, 2015-07, Vol.143 (1), p.014706-014706 [Periódico revisado por pares]United States: American Institute of PhysicsTexto completo disponível |