相关参考文献
注意：仅列出部分参考文献，下载原文获取全部文献信息。Insights into the Emerging Networks of Voids in Simulated Supercooled Water
Narjes Ansari et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2020)
Probing the network topology in network-forming materials: The case of water
Maud Formanek et al.
AIP ADVANCES (2020)
Network Topology in Water Nanoconfined between Phospholipid Membranes
Fausto Martelli et al.
ACS NANO (2020)
Unravelling the contribution of local structures to the anomalies of water: The synergistic action of several factors
Fausto Martelli
JOURNAL OF CHEMICAL PHYSICS (2019)
Electronic coarse graining: Predictive atomistic modeling of condensed matter
F. S. Cipcigan et al.
REVIEWS OF MODERN PHYSICS (2019)
Structure and hydrogen bonding at the limits of liquid water stability
Flaviu Cipcigan et al.
SCIENTIFIC REPORTS (2018)
Large-Scale Structure and Hyperuniformity of Amorphous Ices
Fausto Martelli et al.
PHYSICAL REVIEW LETTERS (2017)
Electronic coarse graining enhances the predictive power of molecular simulation allowing challenges in water physics to be addressed
Flaviu S. Cipcigan et al.
JOURNAL OF COMPUTATIONAL PHYSICS (2016)
Local structure analysis in ab initio liquid water
Biswajit Santra et al.
MOLECULAR PHYSICS (2015)
Hydrogen bonding and molecular orientation at the liquid-vapour interface of water
Flaviu S. Cipcigan et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2015)
Molecular-Scale Remnants of the Liquid-Gas Transition in Supercritical Polar Fluids
V. P. Sokhan et al.
PHYSICAL REVIEW LETTERS (2015)
Signature properties of water: Their molecular electronic origins
Vlad P. Sokhan et al.
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA (2015)
The individual and collective effects of exact exchange and dispersion interactions on the ab initio structure of liquid water
Robert A. DiStasio et al.
JOURNAL OF CHEMICAL PHYSICS (2014)
Metastable liquid-liquid transition in a molecular model of water
Jeremy C. Palmer et al.
NATURE (2014)
Understanding water's anomalies with locally favoured structures
John Russo et al.
NATURE COMMUNICATIONS (2014)
CHARMM General Force Field: A Force Field for Drug-Like Molecules Compatible with the CHARMM All-Atom Additive Biological Force Fields
K. Vanommeslaeghe et al.
JOURNAL OF COMPUTATIONAL CHEMISTRY (2010)
Time-dependent coupled-cluster calculations of polarizabilities and dispersion energy coefficients
Richard J. Wheatley
JOURNAL OF COMPUTATIONAL CHEMISTRY (2008)
Low variance energy estimators for systems of quantum Drude oscillators: Treating harmonic path integrals with large separations of time scales
Troy W. Whitfield et al.
JOURNAL OF CHEMICAL PHYSICS (2007)
A general purpose model for the condensed phases of water: TIP4P/2005
JLF Abascal et al.
JOURNAL OF CHEMICAL PHYSICS (2005)
Evolution of the structure of amorphous ice:: From low-density amorphous through high-density amorphous to very high-density amorphous ice -: art. no. 134501
R Martonák et al.
JOURNAL OF CHEMICAL PHYSICS (2005)
Development and testing of a general amber force field
JM Wang et al.
JOURNAL OF COMPUTATIONAL CHEMISTRY (2004)
Polyamorphism of ice at low temperatures from constant-pressure simulations -: art. no. 225702
R Martonák et al.
PHYSICAL REVIEW LETTERS (2004)
A biomolecular force field based on the free enthalpy of hydration and solvation: The GROMOS force-field parameter sets 53A5 and 53A6
C Oostenbrink et al.
JOURNAL OF COMPUTATIONAL CHEMISTRY (2004)
分享论文
