Synergetic hydrogen-bond network of functionalized graphene and cations for enhanced atmospheric water capture

X Xiaojun Ren X Xiao Sui (School of Marine Science and Technology, Harbin Institute of Technology) A Amir Karton (School of Science and Technology, University of New England) Y Yuta Nishina (Research Core for Interdisciplinary Sciences, Okayama University, 3-1-1 Tsushima-naka, Kita-ku, Okayama 700-8530, Japan) T Tongxi Lin (School of Materials Science and Engineering, University of New South Wales Sydney) D Daisuke Asanoma (Research Institute for Interdisciplinary Science, Okayama University) L Llewellyn Owens (Vesi Water Pty Ltd) D Dali Ji (School of Materials Science and Engineering, University of New South Wales Sydney) X Xinyue Wen (School of Materials Science and Engineering, University of New South Wales Sydney) V Vanesa Quintano (School of Materials Science and Engineering, University of New South Wales Sydney) K Komal Tripathi (Department of Chemical Engineering, Indian Institute of Technology Roorkee) K Kamal K. Pant (Department of Chemical Engineering, Indian Institute of Technology Roorkee) L Liming Dai (ARC Centre of Excellence for Carbon Science and Innovation) D Daria V. Andreeva (Institute for Functional Intelligent Materials, National University of Singapore) T Tobias Foller (School of Materials Science and Engineering, University of New South Wales Sydney) K Kostya S. Novoselov R Rakesh Joshi (School of Materials Science and Engineering, University of New South Wales Sydney)

Abstract

Water molecules at the solid–liquid interface display intricate behaviors sensitive to small changes. The presence of different interfacial components, such as cations or functional groups, shapes the physical and chemical properties of the hydrogen-bond network. Understanding such interfacial hydrogen-bond networks is essential for a large range of applications and scientific questions. To probe the interfacial hydrogen-bond network, atmospheric water capture is a powerful tool. Here, we experimentally observe that a calcium ion on a calcium-intercalated graphene oxide aerogel (Ca-GOA) surface captures 3.2 times more water molecules than in its freestanding state. From experimental Van’t Hoff estimation and density functional theory (DFT) calculations, we uncover the synergistically enhanced hydrogen-bond network of the calcium ion–epoxide complex due to significantly larger polarizations and hydrogen bond enthalpies. This study reveals valuable insights into the interfacial water hydrogen-bond network on functionalized carbon–cation complexed surfaces and potential pathways for future atmospheric water generation technologies.

Article Details

Volume / Issue Vol. 122, Issue 25
Published June 24, 2025
ISSN 0027-8424
Publisher National Academy of Sciences

Authors (17)

X

Xiaojun Ren

X

Xiao Sui

School of Marine Science and Technology, Harbin Institute of Technology

A

Amir Karton

School of Science and Technology, University of New England

Y

Yuta Nishina

Research Core for Interdisciplinary Sciences, Okayama University, 3-1-1 Tsushima-naka, Kita-ku, Okayama 700-8530, Japan

T

Tongxi Lin

School of Materials Science and Engineering, University of New South Wales Sydney

D

Daisuke Asanoma

Research Institute for Interdisciplinary Science, Okayama University

L

Llewellyn Owens

Vesi Water Pty Ltd

D

Dali Ji

School of Materials Science and Engineering, University of New South Wales Sydney

X

Xinyue Wen

School of Materials Science and Engineering, University of New South Wales Sydney

V

Vanesa Quintano

School of Materials Science and Engineering, University of New South Wales Sydney

K

Komal Tripathi

Department of Chemical Engineering, Indian Institute of Technology Roorkee

K

Kamal K. Pant

Department of Chemical Engineering, Indian Institute of Technology Roorkee

L

Liming Dai

ARC Centre of Excellence for Carbon Science and Innovation

D

Daria V. Andreeva

Institute for Functional Intelligent Materials, National University of Singapore

T

Tobias Foller

School of Materials Science and Engineering, University of New South Wales Sydney

K

Kostya S. Novoselov

R

Rakesh Joshi

School of Materials Science and Engineering, University of New South Wales Sydney