Article, 2024

Unraveling thermodynamic anomalies of water: A molecular simulation approach to probe the two-state theory with atomistic and coarse-grained water models

JOURNAL OF CHEMICAL PHYSICS, ISSN 0021-9606, Volume 160, 15, 10.1063/5.0194036

Contributors

Muthachikavil, Aswin 0000-0001-7960-3565 [1] Sun, Gang 0000-0002-4961-720X [2] Peng, Baoliang [3] Tanaka, Hajime (Corresponding author) [4] Kontogeorgis, Georgios M. [1] Liang, Xiao-Dong 0000-0002-2007-546X [1]

Affiliations

  1. [1] Tech Univ Denmark, Ctr Energy Resources Engn, Dept Chem & Biochem Engn, Bldg 229, DK-2800 Lyngby, Denmark
    2. [NORA names: DTU Technical University of Denmark; University; Denmark; Europe, EU; Nordic; OECD];
  2. [2] Beijing Normal Univ, Ctr Adv Quantum Studies, Dept Phys, Beijing 100875, Peoples R China
    3. [NORA names: China; Asia, East];
  3. [3] PetroChina, Res Inst Petr Explorat & Dev RIPED, Beijing 100083, Peoples R China
    4. [NORA names: China; Asia, East];
  4. [4] Univ Tokyo, Inst Ind Sci, 4-6-1 Komaba,Meguro ku, Tokyo 1538505, Japan
    5. [NORA names: Japan; Asia, East; OECD]

Abstract

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