Publisher's Note: "Monte Carlo and theoretical calculations of the first four perturbation coefficients in the high temperature series expansion of the free energy for discrete and core-softened potential models" [J. Chem. Phys. 138, 244115 (2013)] (English)
- New search for: Zhou, Shiqi
- New search for: Zhou, Shiqi
- New search for: Solana, J. R.
In:
The journal of chemical physics
;
139
, 4
; 49901-49901
;
2013
-
ISSN:
- Article (Journal) / Print
-
Title:Publisher's Note: "Monte Carlo and theoretical calculations of the first four perturbation coefficients in the high temperature series expansion of the free energy for discrete and core-softened potential models" [J. Chem. Phys. 138, 244115 (2013)]
-
Contributors:Zhou, Shiqi ( author ) / Solana, J. R.
-
Published in:The journal of chemical physics ; 139, 4 ; 49901-49901
-
Publisher:
- New search for: AIP
-
Place of publication:Melville, NY
-
Publication date:2013
-
ISSN:
-
ZDBID:
-
Type of media:Article (Journal)
-
Type of material:Print
-
Language:English
- New search for: 35.10
- Further information on Basic classification
-
Keywords:
-
Classification:
BKL: 35.10 Physikalische Chemie: Allgemeines -
Source:
Table of contents – Volume 139, Issue 4
The tables of contents are generated automatically and are based on the data records of the individual contributions available in the index of the TIB portal. The display of the Tables of Contents may therefore be incomplete.
- 041101
-
Communication: Some critical features of the potential energy surface for the Cl + H2O → HCl + OH forward and reverse reactionsGuo, Yundong / Zhang, Meiling / Xie, Yaoming / Schaefer, Henry F. et al. | 2013
- 041102
-
Communication: Fundamental equation of state correlation with hybrid data setsRutkai, G. / Thol, M. / Lustig, R. / Span, R. / Vrabec, J. et al. | 2013
- 041103
-
Communication: Long-range angular correlations in liquid waterLiu, Yu / Wu, Jianzhong et al. | 2013
- 044101
-
The multi-configuration self-consistent field method within a polarizable embedded frameworkHedega˚rd, Erik Donovan / List, Nanna H. / Jensen, Hans Jo&slash;rgen Aagaard / Kongsted, Jacob et al. | 2013
- 044102
-
Higher-order kinetic expansion of quantum dissipative dynamics: Mapping quantum networks to kinetic networksWu, Jianlan / Cao, Jianshu et al. | 2013
- 044103
-
Qualitative change of character of dispersive interaction with intermolecular distanceHaslmayr, Johannes / Renger, Thomas et al. | 2013
- 044104
-
A novel Gaussian Binning (1GB) analysis of vibrational state distributions in highly excited H2O from reactive quenching of OH* by H2Conte, Riccardo / Fu, Bina / Kamarchik, Eugene / Bowman, Joel M. et al. | 2013
- 044105
-
Adaptive single replica multiple state transition interface samplingDu, Wei-Na / Bolhuis, Peter G. et al. | 2013
- 044106
-
Generalized coupling parameter expansion: Application to square well and Lennard-Jones fluidsRamana, A. Sai Venkata et al. | 2013
- 044107
-
Numerical integration of the extended variable generalized Langevin equation with a positive Prony representable memory kernelBaczewski, Andrew D. / Bond, Stephen D. et al. | 2013
- 044108
-
Molecular dynamics study of the pressure-dependent terahertz infrared absorption spectrum of α- and γ-RDXPereverzev, Andrey / Sewell, Thomas D. / Thompson, Donald L. et al. | 2013
- 044109
-
Development of a ReaxFF potential for Pd/O and application to palladium oxide formationSenftle, Thomas P. / Meyer, Randall J. / Janik, Michael J. / van Duin, Adri C. T. et al. | 2013
- 044110
-
Coupled electron-nuclear dynamics: Charge migration and charge transfer initiated near a conical intersectionMendive-Tapia, David / Vacher, Morgane / Bearpark, Michael J. / Robb, Michael A. et al. | 2013
- 044111
-
Vibrational solvatochromism: Towards systematic approach to modeling solvation phenomenaBłasiak, Bartosz / Lee, Hochan / Cho, Minhaeng et al. | 2013
- 044112
-
Efficient antisymmetrization algorithm for the partially correlated wave functions in the free complement-local Schro¨dinger equation methodNakashima, Hiroyuki / Nakatsuji, Hiroshi et al. | 2013
- 044113
-
Energy and shape relaxation in binary atomic systems with realistic quantum cross sectionsSospedra-Alfonso, Reinel / Shizgal, Bernie D. et al. | 2013
- 044114
-
General coalescence conditions for the exact wave functions: Higher-order relations for two-particle systemsKurokawa, Yusaku I. / Nakashima, Hiroyuki / Nakatsuji, Hiroshi et al. | 2013
- 044115
-
Entanglement dynamics of two qubits coupled individually to Ohmic bathsDuan, Liwei / Wang, Hui / Chen, Qing-Hu / Zhao, Yang et al. | 2013
- 044116
-
A comparison between state-specific and linear-response formalisms for the calculation of vertical electronic transition energy in solution with the CCSD-PCM methodCaricato, Marco et al. | 2013
- 044117
-
Influence of neighboring reactive particles on diffusion-limited reactionsEun, Changsun / Kekenes-Huskey, Peter M. / McCammon, J. Andrew et al. | 2013
- 044118
-
Multireference configuration interaction theory using cumulant reconstruction with internal contraction of density matrix renormalization group wave functionSaitow, Masaaki / Kurashige, Yuki / Yanai, Takeshi et al. | 2013
- 044119
-
Comparison of volume and surface area nonpolar solvation free energy terms for implicit solvent simulationsLee, Michael S. / Olson, Mark A. et al. | 2013
- 044120
-
Boundary based on exchange symmetry theory for multilevel simulations. I. Basic theoryShiga, Motoyuki / Masia, Marco et al. | 2013
- 044301
-
Magnetic hollow cages with colossal momentsWu, Menghao / Jena, Puru et al. | 2013
- 044302
-
Finite size line broadening and superradiance of optical transitions in two dimensional long-range ordered molecular aggregatesMu¨ller, Mathias / Paulheim, Alexander / Eisfeld, Alexander / Sokolowski, Moritz et al. | 2013
- 044303
-
On the electronic structure of the low lying electronic states of vanadium trioxideLee, Elizabeth M. Y. / Zhu, Xiaolei / Yarkony, David R. et al. | 2013
- 044304
-
Dissipative electron transfer dynamics in mixed valence dimers: Microscopic approach to the solid state problemPalii, Andrew / Bosch-Serrano, Cristian / Clemente-Juan, Juan Modesto / Coronado, Eugenio / Tsukerblat, Boris et al. | 2013
- 044305
-
Field-free orientation by a single-cycle THz pulse: The NaI and IBr moleculesZhao, Ze-Yu / Han, Yong-Chang / Huang, Yin / Cong, Shu-Lin et al. | 2013
- 044306
-
Accurate theoretical study on 18 Λ-S and 50 Ω states of CS in the gas phase: Potential energy curves, spectroscopic parameters, and spin-orbit couplingShi, Deheng / Niu, Xianghong / Sun, Jinfeng / Zhu, Zunlue et al. | 2013
- 044307
-
Laser initiated reactions in N2O clusters studied by time-sliced ion velocity imaging techniqueHonma, Kenji et al. | 2013
- 44308
-
Photoelectron spectroscopy of boron-gold alloy clusters and boron boronyl clusters: B3Aun- and B3(BO)n- (nChen, Qiang et al. | 2013
- 044308
-
Photoelectron spectroscopy of boron-gold alloy clusters and boron boronyl clusters: B3Aun− and B3(BO)n− (n = 1, 2)Chen, Qiang / Bai, Hui / Zhai, Hua-Jin / Li, Si-Dian / Wang, Lai-Sheng et al. | 2013
- 044309
-
Global ab initio ground-state potential energy surface of N4Paukku, Yuliya / Yang, Ke R. / Varga, Zoltan / Truhlar, Donald G. et al. | 2013
- 044310
-
Structures, energies, and bonding in the water heptamerAcelas, Nancy / Hincapie´, Gina / Guerra, Doris / David, Jorge / Restrepo, Albeiro et al. | 2013
- 044311
-
The role of Rydberg states in photoionization of NO2 and (NO+, O−) ion pair formation induced by one VUV photonMarggi Poullain, S. / Veyrinas, K. / Billaud, P. / Lebech, M. / Picard, Y. J. / Lucchese, R. R. / Dowek, D. et al. | 2013
- 044312
-
Photoelectron spectroscopy and theoretical study of M(IO3)2− (M = H, Li, Na, K): Structural evolution, optical isomers, and hyperhalogen behaviorHou, Gao-Lei / Wu, Miao Miao / Wen, Hui / Sun, Qiang / Wang, Xue-Bin / Zheng, Wei-Jun et al. | 2013
- 44312
-
Photoelectron spectroscopy and theoretical study of M(IO3)2- (MHou, Gao-Lei et al. | 2013
- 044313
-
Jet spectroscopy of buckybowl: Electronic and vibrational structures in the S0 and S1 states of triphenylene and sumaneneKunishige, Sachi / Kawabata, Megumi / Baba, Masaaki / Yamanaka, Takaya / Morita, Yuki / Higashibayashi, Shuhei / Sakurai, Hidehiro et al. | 2013
- 044501
-
Observation of nanophase segregation in LiCl aqueous solutions from transient grating experimentsBove, L. E. / Dreyfus, C. / Torre, R. / Pick, R. M. et al. | 2013
- 044502
-
Path integral Monte Carlo study of quantum-hard sphere solidsSese´, Luis M. et al. | 2013
- 044503
-
Ultrafast dynamics of liquid water: Frequency fluctuations of the OH stretch and the HOH bendImoto, Sho / Xantheas, Sotiris S. / Saito, Shinji et al. | 2013
- 044504
-
Length scales and interfacial potentials in ion hydrationShi, Yu / Beck, Thomas L. et al. | 2013
- 044505
-
Influence of Fo¨rster-type energy transfer on the vibrational relaxation of anionic hydration shellsLotze, Stephan / Bakker, Huib J. et al. | 2013
- 044506
-
How a solute-pump/solvent-probe spectroscopy can reveal structural dynamics: Polarizability response spectra as a two-dimensional solvation spectroscopySun, Xiang / Stratt, Richard M. et al. | 2013
- 044507
-
Structure and properties of sodium aluminosilicate glasses from molecular dynamics simulationsXiang, Ye / Du, Jincheng / Smedskjaer, Morten M. / Mauro, John C. et al. | 2013
- 044508
-
The influence of trehalose on hydrophobic interactions of small nonpolar solute: A molecular dynamics simulation studyPaul, Subrata / Paul, Sandip et al. | 2013
- 044509
-
Cooperative dynamic and diffusion behavior above and below the dynamical crossover of supercooled waterPicasso, Germa´n C. / Malaspina, David C. / Carignano, Marcelo A. / Szleifer, Igal et al. | 2013
- 044510
-
Linear and nonlinear density response functions for a simple atomic fluidDalton, Benjamin A. / Glavatskiy, Kirill S. / Daivis, Peter J. / Todd, B. D. / Snook, Ian K. et al. | 2013
- 044701
-
Scale effects in the latent heat of melting in nanoporesShin, J.-H. / Parlange, J.-Y. / Deinert, M. R. et al. | 2013
- 044702
-
Ferroelectric mechanism of croconic acid: A first-principles and Monte Carlo studyCai, Yaxuan / Luo, Shijun / Zhu, Zhanwu / Gu, Haoshuang et al. | 2013
- 044703
-
Charge-induced distortion and stabilization of surface transfer doped porphyrin filmsSmets, Y. / Stark, C. B. / Lach, S. / Schmitt, F. / Wright, C. A. / Wanke, M. / Ley, L. / Ziegler, C. / Pakes, C. I. et al. | 2013
- 044704
-
On the Green-Kubo relationship for the liquid-solid friction coefficientBocquet, Lyde´ric / Barrat, Jean-Louis et al. | 2013
- 044705
-
Methanol synthesis on ZnO(0001). II. Structure, energetics, and vibrational signature of reaction intermediatesKiss, Janos / Frenzel, Johannes / Meyer, Bernd / Marx, Dominik et al. | 2013
- 044706
-
Diffusion, adsorption, and desorption of molecular hydrogen on graphene and in graphitePetucci, Justin / LeBlond, Carl / Karimi, Majid / Vidali, Gianfranco et al. | 2013
- 044707
-
On the fly first principles study of the classical scattering of an Ar atom from the LiF(100) surfaceAzuri, Asaf / Pollak, Eli et al. | 2013
- 044708
-
Comparative study of phenol and thiophenol adsorption on Cu(110)Kitaguchi, Y. / Habuka, S. / Mitsui, T. / Okuyama, H. / Hatta, S. / Aruga, T. et al. | 2013
- 044709
-
Origin of anomalous strain effects on the molecular adsorption on boron-doped grapheneKang, Joongoo / Kim, Yong-Hyun / Glatzmaier, Greg C. / Wei, Su-Huai et al. | 2013
- 044710
-
First-principles thermodynamic screening approach to photo-catalytic water splitting with co-catalystsOberhofer, Harald / Reuter, Karsten et al. | 2013
- 044711
-
Chirality dependence of quantum thermal transport in carbon nanotubes at low temperatures: A first-principles studyHata, Tomoyuki / Kawai, Hiroki / Ohto, Tatsuhiko / Yamashita, Koichi et al. | 2013
- 044712
-
Adsorption of hydrogen on the surface and sub-surface of Cu(111)Mudiyanselage, Kumudu / Yang, Yixiong / Hoffmann, Friedrich M. / Furlong, Octavio J. / Hrbek, Jan / White, Michael G. / Liu, Ping / Stacchiola, Dari´o J. et al. | 2013
- 044713
-
Hollow gold nanorectangles: The roles of polarization and substrateNear, Rachel D. / El-Sayed, Mostafa A. et al. | 2013
- 044714
-
First principles study of hydroxyapatite surfaceSlepko, Alexander / Demkov, Alexander A. et al. | 2013
- 044715
-
Surface-enhanced Raman spectroscopic studies of the Au-pentacene interface: A combined experimental and theoretical investigationAdil, D. / Guha, S. et al. | 2013
- 044716
-
Proton dynamics in ice VII at high pressuresFinkelstein, Y. / Moreh, R. et al. | 2013
- 044901
-
Shape characteristics of equilibrium and non-equilibrium fractal clustersMansfield, Marc L. / Douglas, Jack F. et al. | 2013
- 044902
-
Polymer translocation through a gradient channelZhang, Shuang / Wang, Chao / Sun, Li-Zhen / Li, Chao-Yang / Luo, Meng-Bo et al. | 2013
- 044903
-
Resonance Raman overtones reveal vibrational displacements and dynamics of crystalline and amorphous poly(3-hexylthiophene) chains in fullerene blendsGao, Jian / Grey, John K. et al. | 2013
- 044904
-
Effects of the dipolar interaction on the equilibrium morphologies of a single supramolecular magnetic filament in bulkSa´nchez, Pedro A. / Cerda`, Joan J. / Sintes, Toma´s / Holm, Christian et al. | 2013
- 044905
-
Modified scaling principle for rotational relaxation in a model for suspensions of rigid rodsTse, Ying-Lung Steve / Andersen, Hans C. et al. | 2013
- 044906
-
Modeling the collective relaxation time of glass-forming polymers at intermediate length scales: Application to polyisobutyleneColmenero, Juan / Alvarez, Fernando / Khairy, Yasmin / Arbe, Arantxa et al. | 2013
- 044907
-
Alteration of gas phase ion polarizabilities upon hydration in high dielectric liquidsBuyukdagli, Sahin / Ala-Nissila, T. et al. | 2013
- 044908
-
Kinetics of particle wrapping by a vesicleMirigian, Stephen / Muthukumar, Murugappan et al. | 2013
- 044909
-
Second-order resummed thermodynamic perturbation theory for central-force associating potential: Multi-patch colloidal modelsKalyuzhnyi, Y. V. / Marshall, B. D. / Chapman, W. G. / Cummings, P. T. et al. | 2013
- 044910
-
Conformational switching of modified guest chains in polymer brushesRomeis, D. / Sommer, J.-U. et al. | 2013
- 044911
-
Effects of domain morphology on kinetics of fluid phase separationRoy, Sutapa / Das, Subir K. et al. | 2013
- 044912
-
Confinement dynamics of a semiflexible chain inside nano-spheresFathizadeh, A. / Heidari, Maziar / Eslami-Mossallam, B. / Ejtehadi, M. R. et al. | 2013
- 044913
-
Dendritic brushes under theta and poor solvent conditionsGergidis, Leonidas N. / Kalogirou, Andreas / Charalambopoulos, Antonios / Vlahos, Costas et al. | 2013
- 045101
-
Low absorption state of phycocyanin from Acaryochloris marina antenna system: On the interplay between ionic strength and excitonic couplingNganou, Collins et al. | 2013
- 045102
-
Proteins in the electric field near the surface of micaStarzyk, Anna / Cieplak, Marek et al. | 2013
- 045103
-
Effect of quantum tunneling on single strand breaks in a modeled gas phase cytidine nucleotide induced by low energy electron: A theoretical approachBhaskaran, Renjith / Sarma, Manabendra et al. | 2013
- 045104
-
Critical fluctuations in DOPC/DPPC-d62/cholesterol mixtures: 2H magnetic resonance and relaxationDavis, James H. / Ziani, Latifa / Schmidt, Miranda L. et al. | 2013
- 045105
-
Scaling analysis of bio-molecular dynamics derived from elastic incoherent neutron scattering experimentsDoster, W. / Nakagawa, H. / Appavou, M. S. et al. | 2013
- 046101
-
Note: The universal relations for the critical point parametersApfelbaum, E. M. / Vorob'ev, V. S. et al. | 2013
- 046102
-
Note: Is it symmetric or not?Stanton, John F. et al. | 2013
-
Comment on “Experimental evidence for excess entropy discontinuities in glass-forming solutions” [Bogdan, Anatoli / Loerting, Thomas et al. | 2013
-
Response to “Comment on ‘Experimental evidence for excess entropy discontinuities in glass-forming solutions”’ [Lienhard, Daniel M. / Zobrist, Bernhard / Zuend, Andreas / Krieger, Ulrich K. / Peter, Thomas et al. | 2013
- 049901
-
Publisher's Note: “Monte Carlo and theoretical calculations of the first four perturbation coefficients in the high temperature series expansion of the free energy for discrete and core-softened potential models” [J. Chem. Phys. 138, 244115 (2013)]Zhou, Shiqi / Solana, J. R. et al. | 2013
- 049902
-
Erratum: “First principle evaluation of the chiroptical activity of the di-phenyl-diazene derivatives” [J. Chem. Phys. 137, 124307 (2012)]Benassi, Enrico / Corni, Stefano et al. | 2013