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Items: 1 to 50 of 59

1.

State variables for glasses: The case of amorphous ice.

Giovambattista N, Starr FW, Poole PH.

J Chem Phys. 2019 Jun 14;150(22):224502. doi: 10.1063/1.5092586.

PMID:
31202217
2.

Comparative Study of the Effects of Temperature and Pressure on the Water-Mediated Interactions between Apolar Nanoscale Solutes.

Engstler J, Giovambattista N.

J Phys Chem B. 2019 Feb 7;123(5):1116-1128. doi: 10.1021/acs.jpcb.8b10296. Epub 2019 Jan 23.

PMID:
30592598
3.

Temperature Effects on Water-Mediated Interactions at the Nanoscale.

Engstler J, Giovambattista N.

J Phys Chem B. 2018 Sep 27;122(38):8908-8920. doi: 10.1021/acs.jpcb.8b05430. Epub 2018 Sep 17.

PMID:
30178667
4.

Phase Diagram of Water Confined by Graphene.

Gao Z, Giovambattista N, Sahin O.

Sci Rep. 2018 Apr 18;8(1):6228. doi: 10.1038/s41598-018-24358-3.

5.

Nuclear quantum effects on the liquid-liquid phase transition of a water-like monatomic liquid.

Nguyen B, Lopez GE, Giovambattista N.

Phys Chem Chem Phys. 2018 Mar 28;20(12):8210-8217. doi: 10.1039/c7cp08505b. Epub 2018 Mar 12.

PMID:
29528051
6.

Anomalous Features in the Potential Energy Landscape of a Waterlike Monatomic Model with Liquid and Glass Polymorphism.

Sun G, Xu L, Giovambattista N.

Phys Rev Lett. 2018 Jan 19;120(3):035701. doi: 10.1103/PhysRevLett.120.035701.

PMID:
29400533
7.

Large-Scale Structure and Hyperuniformity of Amorphous Ices.

Martelli F, Torquato S, Giovambattista N, Car R.

Phys Rev Lett. 2017 Sep 29;119(13):136002. doi: 10.1103/PhysRevLett.119.136002. Epub 2017 Sep 29.

PMID:
29341697
8.

Heating- and pressure-induced transformations in amorphous and hexagonal ice: A computer simulation study using the TIP4P/2005 model.

Engstler J, Giovambattista N.

J Chem Phys. 2017 Aug 21;147(7):074505. doi: 10.1063/1.4998747.

PMID:
28830166
9.

Influence of sample preparation on the transformation of low-density to high-density amorphous ice: An explanation based on the potential energy landscape.

Giovambattista N, Starr FW, Poole PH.

J Chem Phys. 2017 Jul 28;147(4):044501. doi: 10.1063/1.4993567.

PMID:
28764372
10.

Structure and mobility of water confined in AlPO4-54 nanotubes.

Gavazzoni C, Giovambattista N, Netz PA, Barbosa MC.

J Chem Phys. 2017 Jun 21;146(23):234509. doi: 10.1063/1.4985626.

11.
12.

Potential energy landscape of the apparent first-order phase transition between low-density and high-density amorphous ice.

Giovambattista N, Sciortino F, Starr FW, Poole PH.

J Chem Phys. 2016 Dec 14;145(22):224501.

PMID:
27984880
13.

Glass polymorphism in glycerol-water mixtures: I. A computer simulation study.

Jahn DA, Wong J, Bachler J, Loerting T, Giovambattista N.

Phys Chem Chem Phys. 2016 Apr 28;18(16):11042-57. doi: 10.1039/c6cp00075d.

14.

Glass polymorphism in glycerol-water mixtures: II. Experimental studies.

Bachler J, Fuentes-Landete V, Jahn DA, Wong J, Giovambattista N, Loerting T.

Phys Chem Chem Phys. 2016 Apr 28;18(16):11058-68. doi: 10.1039/c5cp08069j.

15.

Confinement effects on the liquid-liquid phase transition and anomalous properties of a monatomic water-like liquid.

Sun G, Giovambattista N, Xu L.

J Chem Phys. 2015 Dec 28;143(24):244503. doi: 10.1063/1.4937486.

PMID:
26723688
16.

Pressure-induced transformations in glassy water: A computer simulation study using the TIP4P/2005 model.

Wong J, Jahn DA, Giovambattista N.

J Chem Phys. 2015 Aug 21;143(7):074501. doi: 10.1063/1.4928435.

PMID:
26298139
17.

Effects of temperature on the thermodynamic and dynamical properties of glycerol-water mixtures: a computer simulation study of three different force fields.

Akinkunmi FO, Jahn DA, Giovambattista N.

J Phys Chem B. 2015 May 21;119(20):6250-61. doi: 10.1021/acs.jpcb.5b00439. Epub 2015 May 8.

PMID:
25901644
18.

Effects of temperature on the properties of glycerol: a computer simulation study of five different force fields.

Jahn DA, Akinkunmi FO, Giovambattista N.

J Phys Chem B. 2014 Sep 25;118(38):11284-94. doi: 10.1021/jp5059098. Epub 2014 Sep 16.

PMID:
25188739
19.

Glass transitions in a monatomic liquid with two glassy states.

Gordon A, Giovambattista N.

Phys Rev Lett. 2014 Apr 11;112(14):145701. Epub 2014 Apr 7.

PMID:
24765988
20.

Heating-induced glass-glass and glass-liquid transformations in computer simulations of water.

Chiu J, Starr FW, Giovambattista N.

J Chem Phys. 2014 Mar 21;140(11):114504. doi: 10.1063/1.4868028.

PMID:
24655190
21.

Pressure-induced transformations in computer simulations of glassy water.

Chiu J, Starr FW, Giovambattista N.

J Chem Phys. 2013 Nov 14;139(18):184504. doi: 10.1063/1.4829276.

PMID:
24320281
22.

Glass and liquid phase diagram of a polyamorphic monatomic system.

Reisman S, Giovambattista N.

J Chem Phys. 2013 Feb 14;138(6):064509. doi: 10.1063/1.4790404.

PMID:
23425481
23.

A computational investigation of the phase behavior and capillary sublimation of water confined between nanoscale hydrophobic plates.

Ferguson AL, Giovambattista N, Rossky PJ, Panagiotopoulos AZ, Debenedetti PG.

J Chem Phys. 2012 Oct 14;137(14):144501. doi: 10.1063/1.4755750.

PMID:
23061849
24.

Interplay of the glass transition and the liquid-liquid phase transition in water.

Giovambattista N, Loerting T, Lukanov BR, Starr FW.

Sci Rep. 2012;2:390. doi: 10.1038/srep00390. Epub 2012 May 1.

25.

Computational studies of pressure, temperature, and surface effects on the structure and thermodynamics of confined water.

Giovambattista N, Rossky PJ, Debenedetti PG.

Annu Rev Phys Chem. 2012;63:179-200. doi: 10.1146/annurev-physchem-032811-112007.

PMID:
22475337
26.

Liquid and glass polymorphism in a monatomic system with isotropic, smooth pair interactions.

Abraham JY, Buldyrev SV, Giovambattista N.

J Phys Chem B. 2011 Dec 8;115(48):14229-39. doi: 10.1021/jp205098a. Epub 2011 Oct 12.

PMID:
21992558
27.

Waterlike glass polyamorphism in a monoatomic isotropic Jagla model.

Xu L, Giovambattista N, Buldyrev SV, Debenedetti PG, Stanley HE.

J Chem Phys. 2011 Feb 14;134(6):064507. doi: 10.1063/1.3521486.

PMID:
21322705
28.

Hydrogen bond strength and network structure effects on hydration of non-polar molecules.

Lynden-Bell RM, Giovambattista N, Debenedetti PG, Head-Gordon T, Rossky PJ.

Phys Chem Chem Phys. 2011 Feb 21;13(7):2748-57. doi: 10.1039/c0cp01701a. Epub 2010 Dec 10.

29.

Liquid-liquid phase transition and glass transition in a monoatomic model system.

Xu L, Buldyrev SV, Giovambattista N, Stanley HE.

Int J Mol Sci. 2010;11(12):5184-200. doi: 10.3390/ijms11125184. Epub 2010 Dec 16.

30.

Unusual phase behavior of one-component systems with two-scale isotropic interactions.

Buldyrev SV, Malescio G, Angell CA, Giovambattista N, Prestipino S, Saija F, Stanley HE, Xu L.

J Phys Condens Matter. 2009 Dec 16;21(50):504106. doi: 10.1088/0953-8984/21/50/504106. Epub 2009 Nov 23.

PMID:
21836217
31.

Enhanced surface hydrophobicity by coupling of surface polarity and topography.

Giovambattista N, Debenedetti PG, Rossky PJ.

Proc Natl Acad Sci U S A. 2009 Sep 8;106(36):15181-5. doi: 10.1073/pnas.0905468106. Epub 2009 Aug 14. Erratum in: Proc Natl Acad Sci U S A. 2013 Apr 16;110(16):6608.

32.

Evolution from surface-influenced to bulk-like dynamics in nanoscopically confined water.

Romero-Vargas Castrillón S, Giovambattista N, Aksay IA, Debenedetti PG.

J Phys Chem B. 2009 Jun 11;113(23):7973-6. doi: 10.1021/jp9025392.

PMID:
19449830
33.

Effect of temperature on the structure and phase behavior of water confined by hydrophobic, hydrophilic, and heterogeneous surfaces.

Giovambattista N, Rossky PJ, Debenedetti PG.

J Phys Chem B. 2009 Oct 22;113(42):13723-34. doi: 10.1021/jp9018266.

PMID:
19435300
34.

Phase transitions induced by nanoconfinement in liquid water.

Giovambattista N, Rossky PJ, Debenedetti PG.

Phys Rev Lett. 2009 Feb 6;102(5):050603. Epub 2009 Feb 6.

PMID:
19257497
35.

Structural and mechanical properties of glassy water in nanoscale confinement.

Lombardo TG, Giovambattista N, Debenedetti PG.

Faraday Discuss. 2009;141:359-76; discussion 443-65.

PMID:
19227365
36.

A monatomic system with a liquid-liquid critical point and two distinct glassy states.

Xu L, Buldyrev SV, Giovambattista N, Angell CA, Stanley HE.

J Chem Phys. 2009 Feb 7;130(5):054505. doi: 10.1063/1.3043665.

PMID:
19206982
37.

Effect of surface polarity on the structure and dynamics of water in nanoscale confinement.

Romero-Vargas Castrillón S, Giovambattista N, Aksay IA, Debenedetti PG.

J Phys Chem B. 2009 Feb 5;113(5):1438-46. doi: 10.1021/jp809032n.

PMID:
19143545
38.

Correspondence between phase diagrams of the TIP5P water model and a spherically symmetric repulsive ramp potential with two characteristic length scales.

Yan Z, Buldyrev SV, Kumar P, Giovambattista N, Stanley HE.

Phys Rev E Stat Nonlin Soft Matter Phys. 2008 Apr;77(4 Pt 1):042201. Epub 2008 Apr 23.

PMID:
18517671
39.

Hydrophobicity of protein surfaces: Separating geometry from chemistry.

Giovambattista N, Lopez CF, Rossky PJ, Debenedetti PG.

Proc Natl Acad Sci U S A. 2008 Feb 19;105(7):2274-9. doi: 10.1073/pnas.0708088105. Epub 2008 Feb 11.

40.

Structure of the first- and second-neighbor shells of simulated water: quantitative relation to translational and orientational order.

Yan Z, Buldyrev SV, Kumar P, Giovambattista N, Debenedetti PG, Stanley HE.

Phys Rev E Stat Nonlin Soft Matter Phys. 2007 Nov;76(5 Pt 1):051201. Epub 2007 Nov 9.

PMID:
18233643
41.

Connection of translational and rotational dynamical heterogeneities with the breakdown of the Stokes-Einstein and Stokes-Einstein-Debye relations in water.

Mazza MG, Giovambattista N, Stanley HE, Starr FW.

Phys Rev E Stat Nonlin Soft Matter Phys. 2007 Sep;76(3 Pt 1):031203. Epub 2007 Sep 26.

PMID:
17930235
42.

Effect of surface polarity on water contact angle and interfacial hydration structure.

Giovambattista N, Debenedetti PG, Rossky PJ.

J Phys Chem B. 2007 Aug 16;111(32):9581-7. Epub 2007 Jul 21.

PMID:
17658789
43.

Family of tunable spherically symmetric potentials that span the range from hard spheres to waterlike behavior.

Yan Z, Buldyrev SV, Giovambattista N, Debenedetti PG, Stanley HE.

Phys Rev E Stat Nonlin Soft Matter Phys. 2006 May;73(5 Pt 1):051204. Epub 2006 May 17.

PMID:
16802925
44.

Effect of pressure on the phase behavior and structure of water confined between nanoscale hydrophobic and hydrophilic plates.

Giovambattista N, Rossky PJ, Debenedetti PG.

Phys Rev E Stat Nonlin Soft Matter Phys. 2006 Apr;73(4 Pt 1):041604. Epub 2006 Apr 13.

PMID:
16711818
45.

Relation between rotational and translational dynamic heterogeneities in water.

Mazza MG, Giovambattista N, Starr FW, Stanley HE.

Phys Rev Lett. 2006 Feb 10;96(5):057803. Epub 2006 Feb 9.

PMID:
16486991
46.

Thermodynamics, structure, and dynamics of water confined between hydrophobic plates.

Kumar P, Buldyrev SV, Starr FW, Giovambattista N, Stanley HE.

Phys Rev E Stat Nonlin Soft Matter Phys. 2005 Nov;72(5 Pt 1):051503. Epub 2005 Nov 11.

PMID:
16383607
47.

Phase diagram of amorphous solid water: low-density, high-density, and very-high-density amorphous ices.

Giovambattista N, Stanley HE, Sciortino F.

Phys Rev E Stat Nonlin Soft Matter Phys. 2005 Sep;72(3 Pt 1):031510. Epub 2005 Sep 30.

PMID:
16241447
48.

Structural order for one-scale and two-scale potentials.

Yan Z, Buldyrev SV, Giovambattista N, Stanley HE.

Phys Rev Lett. 2005 Sep 23;95(13):130604. Epub 2005 Sep 22.

PMID:
16197129
49.

Structural relaxation in the glass transition region of water.

Giovambattista N, Angell CA, Sciortino F, Stanley HE.

Phys Rev E Stat Nonlin Soft Matter Phys. 2005 Jul;72(1 Pt 1):011203. Epub 2005 Jul 19.

PMID:
16089947
50.

Clusters of mobile molecules in supercooled water.

Giovambattista N, Buldyrev SV, Stanley HE, Starr FW.

Phys Rev E Stat Nonlin Soft Matter Phys. 2005 Jul;72(1 Pt 1):011202. Epub 2005 Jul 13.

PMID:
16089946

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