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La ricerca find articoli where soggetti phrase all words 'canonical ensemble' sort by level,fasc_key/DESCEND, pagina_ini_num/ASCEND ha restituito 170 riferimenti
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    1. Kalinichev, AG
      Molecular simulations of liquid and supercritical water: Thermodynamics, structure, and hydrogen bonding

      MOLECULAR MODELING THEORY: APPLICATIONS IN THE GEOSCIENCES
    2. Ciccotti, G; Martyna, GJ; Melchionna, S; Tuckerman, ME
      Constrained isothermal-isobaric molecular dynamics with full atomic virial

      JOURNAL OF PHYSICAL CHEMISTRY B
    3. Alekseev, VA
      Statistics of an ideal homogeneous Bose gas with a fixed number of particles

      QUANTUM ELECTRONICS
    4. Sergi, A; Ferrario, M
      Non-Hamiltonian equations of motion with a conserved energy - art. no. 056125

      PHYSICAL REVIEW E
    5. Almarza, NG; Enciso, E; Garcia, MF; Gonzalez, MA; Bermejo, FJ
      Reentrant miscibility in fluids with spherical interactions - art. no. 012501

      PHYSICAL REVIEW E
    6. Chen, JH; Jing, JL; Wang, YJ
      Thermodynamics of global monopole anti-de-Sitter black hole in grand canonical ensemble

      CHINESE PHYSICS
    7. Gavalda, S; Kaneko, K; Thomson, KT; Gubbins, KE
      Molecular modeling of carbon aerogels

      COLLOIDS AND SURFACES A-PHYSICOCHEMICAL AND ENGINEERING ASPECTS
    8. Sweatman, MB; Quirke, N
      Modelling gas adsorption in slit-pores using Monte Carlo simulation

      MOLECULAR SIMULATION
    9. Smith, AV; Hall, CK
      alpha-helix formation: Discontinuous molecular dynamics on an intermediate-resolution protein model

      PROTEINS-STRUCTURE FUNCTION AND GENETICS
    10. Cao, DP; Wang, WC; Duan, X; Jiao, QZ
      Monte Carlo simulation of natural gas adsorption storage in pillared layered material

      ACTA CHIMICA SINICA
    11. Hong, ST; Kim, WT; Oh, JJ; Park, YJ
      Higher dimensional flat embeddings of black strings in 2+1 dimensions - art. no. 127502

      PHYSICAL REVIEW D
    12. Medved, AJM; Kunstatter, G
      One-loop corrected thermodynamics of the extremal and nonextremal spinningBanados-Teitelboim-Zanelli black hole - art. no. 104005

      PHYSICAL REVIEW D
    13. Holthaus, M; Kapale, KT; Kocharovsky, VV; Scully, MO
      Master equation vs. partition function: canonical statistics of ideal Bose-Einstein condensates

      PHYSICA A
    14. Mentrup, D; Schnack, J
      Nose-Hoover dynamics for coherent states

      PHYSICA A
    15. Chen, JH; Jing, JL; Wang, YJ
      (2+1)-dimensional AdS black hole in grand canonical ensemble

      COMMUNICATIONS IN THEORETICAL PHYSICS
    16. Hou, TJ; Zhu, LL; Xu, XJ; Ji, MJ; Ye, XQ
      Adsorption of some aromatic compounds in ITQ-1 zeolite: Grand canonical Monte Carlo simulations

      CHEMICAL JOURNAL OF CHINESE UNIVERSITIES-CHINESE
    17. Wang, B; Su, RK; Abdalla, E
      Extreme black hole entropy obtained in an operational approach

      INTERNATIONAL JOURNAL OF MODERN PHYSICS A
    18. Qiu, WG; Xu, JJ; Su, RK; Wang, B
      Quantum corrections to the entropy of extreme Reissner-Nordstrom black holes

      MODERN PHYSICS LETTERS A
    19. Wang, BB; Huang, CG
      Thermodynamics of de Sitter space-time in York's formalism

      MODERN PHYSICS LETTERS A
    20. Gozdz, WT
      Phase separation of binary mixtures of symmetric non-additive hard spheres

      POLISH JOURNAL OF CHEMISTRY
    21. Koga, S
      Unified treatment of Birkhoff coordinates in billiard systems of particlesmoving under an influence of a potential including particle-particle interaction

      JOURNAL OF THE PHYSICAL SOCIETY OF JAPAN
    22. Teramoto, T
      Canonical ensemble average of the lamellar fluctuations

      JOURNAL OF THE PHYSICAL SOCIETY OF JAPAN
    23. Kapale, KT; Zubairy, MS
      Equivalence of the master equation approach to the canonical ensemble approach for an ideal Bose gas

      OPTICS COMMUNICATIONS
    24. Kim, SC; Nemeth, ZT; Heni, M; Lowen, H
      Hard discs in circular cavities: density functional theory versus simulation

      MOLECULAR PHYSICS
    25. Aqua, JN; Cornu, F
      Density profiles in a classical Coulomb fluid near a dielectric wall. II. Weak-coupling systematic expansions

      JOURNAL OF STATISTICAL PHYSICS
    26. Tuckerman, ME; Liu, Y; Ciccotti, G; Martyna, GJ
      Non-Hamiltonian molecular dynamics: Generalizing Hamiltonian phase space principles to non-Hamiltonian systems

      JOURNAL OF CHEMICAL PHYSICS
    27. VandeVondele, J; Rothlisberger, U
      Estimating equilibrium properties from non-Hamiltonian dynamics

      JOURNAL OF CHEMICAL PHYSICS
    28. Stern, HA; Berne, BJ
      Quantum effects in liquid water: Path-integral simulations of a flexible and polarizable ab initio model

      JOURNAL OF CHEMICAL PHYSICS
    29. Hoover, WG; Posch, HA; Hoover, CG
      Fluctuations and asymmetry via local Lyapunov instability in the time-reversible doubly thermostated harmonic oscillator

      JOURNAL OF CHEMICAL PHYSICS
    30. Molteni, C; Martonak, R; Parrinello, M
      First principles molecular dynamics simulations of pressure-induced structural transformations in silicon clusters

      JOURNAL OF CHEMICAL PHYSICS
    31. Schutte, C; Huisinga, W; Deuflhard, P
      Transfer operator approach to conformational dynamics in biomolecular systems

      ERGODIC THEORY, ANALYSIS, AND EFFICIENT SIMULATION OF DYNAMICAL SYSTEMS
    32. Vandernoot, TJ
      Factors affecting the calculation of mean ionic activities in Monte Carlo simulations of primitive electrolytes

      PCCP PHYSICAL CHEMISTRY CHEMICAL PHYSICS
    33. Hill, JR; Minihan, AR; Wimmer, E; Adams, CJ
      Framework dynamics including computer simulations of the water adsorption isotherm of zeolite Na-MAP

      PHYSICAL CHEMISTRY CHEMICAL PHYSICS
    34. Puddu, G
      Monte Carlo calculations of angular momentum projected many-body matrix elements in the Pairing Plus Quadrupole Model

      EUROPEAN PHYSICAL JOURNAL A
    35. Lobaugh, J; Rossky, PJ
      Solvent and intramolecular effects on the absorption spectrum of betaine-30

      JOURNAL OF PHYSICAL CHEMISTRY A
    36. Mundy, CJ; Balasubramanian, S; Bagchi, K; Tuckerman, ME; Martyna, GJ; Klein, ML
      Nonequilibrium molecular dynamics

      REVIEWS IN COMPUTATIONAL CHEMISTRY, VOL 14
    37. Branka, AC; Wojciechowski, KW
      Generalization of Nose and Nose-Hoover isothermal dynamics

      PHYSICAL REVIEW E
    38. Hai, L
      A new entropy of black hole in accordance with the third law of thermodynamics

      ACTA PHYSICA SINICA
    39. Ota, SB; Ota, S
      Microcanonical Monte Carlo simulations of the first-order transition in the two-dimensional Potts model

      JOURNAL OF PHYSICS-CONDENSED MATTER
    40. Thomson, KT; Gubbins, KE
      Modeling structural morphology of microporous carbons by reverse Monte Carlo

      LANGMUIR
    41. Jin, WZ; Wang, WC
      Molecular simulation of adsorption of Stockmayer fluid in activated carbonpores

      ACTA CHIMICA SINICA
    42. Hou, TJ; Zhu, LL; Xu, XJ
      Adsorption of benzene in MCM-22 zeolite by grand canonical Monte Carlo simulation

      ACTA CHIMICA SINICA
    43. Kim, YW; Park, YJ; Soh, KS
      Reissner-Nordstrom-AdS black hole in the GEMS approach - art. no. 104020

      PHYSICAL REVIEW D
    44. Hong, ST; Kim, WT; Kim, YW; Park, YJ
      Global embeddings of scalar-tensor theories in 2+1 dimensions - art. no. 064021

      PHYSICAL REVIEW D
    45. Wang, B; Abdalla, E; Su, RK
      Geometry and topology of two kinds of extreme Reissner-Nordstrom-anti-de Sitter black holes - art. no. 047501

      PHYSICAL REVIEW D
    46. Hong, ST; Kim, YW; Park, YJ
      Higher dimensional flat embeddings of (2+1)-dimensional black holes - art.no. 024024

      PHYSICAL REVIEW D
    47. Lederer, M
      Quantization of the canonical ensemble

      PHYSICA A
    48. Mentrup, D; Schmidt, HJ; Schnack, J; Luban, M
      Transition from quantum to classical Heisenberg trimers: thermodynamics and time correlation functions

      PHYSICA A
    49. Parvan, AS; Toneev, VD; Ploszajczak, M
      Quantum statistical model of nuclear multifragmentation in the canonical ensemble method

      NUCLEAR PHYSICS A
    50. Zaslavskii, OB
      Non-extreme black holes near the extreme state and acceleration horizons: thermodynamics and quantum-corrected geometry

      CLASSICAL AND QUANTUM GRAVITY
    51. Mitra, P
      Charged black holes in asymptotically anti-de Sitter spacetime

      INTERNATIONAL JOURNAL OF MODERN PHYSICS B
    52. Koga, S
      Canonical coordinates defined on a curved Poincare section and a relation to micro-canonical averages in nonlinear hamiltonian dynamical system

      JOURNAL OF THE PHYSICAL SOCIETY OF JAPAN
    53. Strnad, M; Nezbeda, I
      Parallelized sampling of the Gibbs ensemble

      MOLECULAR PHYSICS
    54. Rateitschak, K; Klages, R; Hoover, WG
      The Nose-Hoover thermostated Lorentz gas

      JOURNAL OF STATISTICAL PHYSICS
    55. Morishita, T
      Fluctuation formulas in molecular-dynamics simulations with the weak coupling heat bath

      JOURNAL OF CHEMICAL PHYSICS
    56. Mantz, YA; Geiger, FM; Molina, LT; Molina, MJ; Trout, BL
      First-principles molecular-dynamics study of surface disordering of the (0001) face of hexagonal ice

      JOURNAL OF CHEMICAL PHYSICS
    57. Bedrov, D; Smith, GD
      Thermal conductivity of molecular fluids from molecular dynamics simulations: Application of a new imposed-flux method

      JOURNAL OF CHEMICAL PHYSICS
    58. Heffelfinger, GS
      Parallel atomistic simulations

      COMPUTER PHYSICS COMMUNICATIONS
    59. Tuckerman, ME; Yarne, DA; Samuelson, SO; Hughes, AL; Martyna, GJ
      Exploiting multiple levels of parallelism in Molecular Dynamics based calculations via modern techniques and software paradigms on distributed memorycomputers

      COMPUTER PHYSICS COMMUNICATIONS
    60. Nardelli, MB; Fattebert, JL; Orlikowski, D; Roland, C; Zhao, Q; Bernholc, J
      Mechanical properties, defects and electronic behavior of carbon nanotubes

      CARBON
    61. Ungar, LW; Newton, MD; Voth, GA
      Classical and quantum simulation of electron transfer through a polypeptide

      JOURNAL OF PHYSICAL CHEMISTRY B
    62. Chen, B; Siepmann, JI
      Monte Carlo algorithms for simulating systems with adiabatic separation ofelectronic and nuclear degrees of freedom

      THEORETICAL CHEMISTRY ACCOUNTS
    63. Somer, FL; Hernandez, R
      Stochastic dynamics in irreversible nonequilibrium environments. 3. Temperature-ramped chemical kinetics

      JOURNAL OF PHYSICAL CHEMISTRY A
    64. Zhao, Z; Zhu, JY
      Nernst theorem and Planck absolute entropy of black hole

      ACTA PHYSICA SINICA
    65. Strnad, M; Nezbeda, I
      An extended Gibbs ensemble

      MOLECULAR SIMULATION
    66. Gelb, LD; Gubbins, KE
      Pore size distributions in porous glasses: A computer simulation study

      LANGMUIR
    67. Wang, B; Su, RK
      Entropy and topology of two-dimensional extreme black holes - art. no. 104006

      PHYSICAL REVIEW D
    68. Mentrup, D; Schnack, J; Luban, M
      Spin dynamics of quantum and classical Heisenberg dimers

      PHYSICA A
    69. Plastino, AR; Plastino, A; da Silva, LR; Casas, M
      Dynamical thermostatting, divergenceless phase-space flows, and KBB systems

      PHYSICA A
    70. Schmidt, HJ; Schnack, J
      Thermodynamic fermion-boson symmetry in harmonic oscillator potentials

      PHYSICA A
    71. Wang, B; Abdalla, E
      Entropy of extreme three-dimensional charged black holes

      PHYSICS LETTERS B
    72. Balian, R; Flocard, H; Veneroni, M
      Variational extensions of BCS theory

      PHYSICS REPORTS-REVIEW SECTION OF PHYSICS LETTERS
    73. Zhao, Z; Zhu, JY; Liu, WB
      Entropy of Kerr-Newman black hole continuously goes to zero when the hole changes from nonextreme case to extreme case

      CHINESE PHYSICS LETTERS
    74. Wang, B; Su, RK
      Different quantum entropies for two kinds of extreme two-dimensional Lowe-Strominger black holes

      COMMUNICATIONS IN THEORETICAL PHYSICS
    75. Wang, B; Su, RK
      Geometry and entropy of two kinds of extreme Kerr-Newmann black holes

      COMMUNICATIONS IN THEORETICAL PHYSICS
    76. Falk, ML
      Molecular-dynamics study of ductile and brittle fracture in model noncrystalline solids

      PHYSICAL REVIEW B-CONDENSED MATTER
    77. Morishita, T; Nose, S
      Momentum conservation law in the Car-Parrinello method

      PHYSICAL REVIEW B-CONDENSED MATTER
    78. Gelb, LD; Gubbins, KE; Radhakrishnan, R; Sliwinska-Bartkowiak, M
      Phase separation in confined systems

      REPORTS ON PROGRESS IN PHYSICS
    79. Sergi, A; Ferrario, M; Costa, D
      Reversible integrators for basic extended system molecular dynamics

      MOLECULAR PHYSICS
    80. Gelb, LD; Gubbins, KE
      Correlation functions of adsorbed fluids in porous glass: a computer simulation study

      MOLECULAR PHYSICS
    81. Bond, SD; Leimkuhler, BJ; Laird, BB
      The Nose-Poincare method for constant temperature molecular dynamics

      JOURNAL OF COMPUTATIONAL PHYSICS
    82. Escobedo, FA
      Tracing coexistence lines in multicomponent fluid mixtures by molecular simulation

      JOURNAL OF CHEMICAL PHYSICS
    83. Kusaka, I; Oxtoby, DW
      Identifying physical clusters in vapor phase nucleation

      JOURNAL OF CHEMICAL PHYSICS
    84. Fang, ZW; Haymet, ADJ; Shinoda, W; Okazaki, S
      Parallel molecular dynamics simulation: implementation of PVM for a lipid membrane

      COMPUTER PHYSICS COMMUNICATIONS
    85. TUNON I; SILLA E; MILLOT C; MARTINSCOSTA MTC; RUIZLOPEZ MF
      INTRAMOLECULAR PROTON-TRANSFER OF GLYCINE IN AQUEOUS-SOLUTION USING QUANTUM MECHANICS-MOLECULAR MECHANICS SIMULATIONS

      The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory
    86. FALK ML; LANGER JS
      DYNAMICS OF VISCOPLASTIC DEFORMATION IN AMORPHOUS SOLIDS

      Physical review. E, Statistical physics, plasmas, fluids, and related interdisciplinary topics
    87. BURDA Z
      LATTICE MODELS OF RANDOM GEOMETRIES

      ACTA PHYSICA POLONICA B
    88. SCHMIDT HJ; SCHNACK J
      INVESTIGATIONS ON FINITE IDEAL QUANTUM GASES

      Physica. A
    89. SCHNACK J
      MOLECULAR-DYNAMICS INVESTIGATIONS ON A QUANTUM SYSTEM IN A THERMOSTAT

      Physica. A
    90. WANG B; SU RK; YU PKN
      QUANTUM ENTROPY OF 2-DIMENSIONAL EXTREME CHARGED DILATON BLACK-HOLE

      Physics letters. Section B
    91. Mitra, P
      Entropy of extremal black holes in asymptotically anti-de Sitter spacetime

      PHYSICS LETTERS B
    92. NARDELLI MB; YAKOBSON BI; BERNHOLC J
      MECHANISM OF STRAIN RELEASE IN CARBON NANOTUBES

      Physical review. B, Condensed matter
    93. Kalmykov, GI
      Estimating the convergence radius of Mayer expansions: The nonnegative potential case

      THEORETICAL AND MATHEMATICAL PHYSICS
    94. HAYOUN M; PONTIKIS V; WINTER C
      COMPUTER-SIMULATION STUDY OF SURFACE SEGREGATION ON CU3AU

      Surface science
    95. GHOSH A; MITRA P
      COMMENT ON UNDERSTANDING THE AREA PROPOSAL FOR EXTREMAL BLACK-HOLE ENTROPY - REPLY

      Physical review letters
    96. KRONOME G; LISZI J; SZALAI I
      MONTE-CARLO SIMULATION OF SOME THERMOPHYSICAL PROPERTIES OF 2-CENTER LENNARD-JONES FLUIDS ALONG THE VAPOR-LIQUID-EQUILIBRIUM CURVE

      Molecular physics
    97. Gerisch, T; Munzner, R; Rieckers, A
      Canonical versus grand-canonical free energies and phase diagrams of a bipolaronic superconductor model

      JOURNAL OF STATISTICAL PHYSICS
    98. KINUGAWA K; MOORE PB; KLEIN ML
      CENTROID PATH-INTEGRAL MOLECULAR-DYNAMICS STUDIES OF A PARA-HYDROGEN SLAB CONTAINING A LITHIUM IMPURITY

      The Journal of chemical physics
    99. THOMPSON AP; FORD DM; HEFFELFINGER GS
      DIRECT MOLECULAR SIMULATION OF GRADIENT-DRIVEN DIFFUSION

      The Journal of chemical physics
    100. CACCAMO C; COSTA D; PELLICANE G
      A COMPREHENSIVE STUDY OF THE PHASE-DIAGRAM OF SYMMETRICAL HARD-CORE YUKAWA MIXTURES

      The Journal of chemical physics


ASDD Area Sistemi Dipartimentali e Documentali, Università di Bologna, Catalogo delle riviste ed altri periodici
Documento generato il 24/10/20 alle ore 19:53:21