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@ARTICLE{Gieelmann:596100,
      author       = {Gießelmann, Niels C. and Lenz, Philip and Meinert,
                      Sophia-Marie and Simon, Tamás and Jo, Wonhyuk and Striker,
                      Nele N. and Fröba, Michael and Lehmkühler, Felix},
      title        = {{T}he {S}tructure of {W}ater {U}nder {C}onfinement in
                      {P}eriodic {M}esoporous {O}rganosilicas {I}nvestigated by
                      {X}-{R}ay {S}cattering},
      journal      = {The journal of physical chemistry / C},
      volume       = {128},
      number       = {1},
      issn         = {1932-7447},
      address      = {Washington, DC},
      publisher    = {Soc.},
      reportid     = {PUBDB-2023-06048},
      pages        = {499-507},
      year         = {2024},
      abstract     = {The effect of pore wall chemistry and pore diameter on the
                      structure of confined water was studied by X-ray scattering
                      on water confined in periodic mesoporous organosilicas
                      (PMOs). A shift in the first structure factor peak at q
                      $≈$ 1.8 Å$^{−1}$ reveals a variation in the density of
                      the confined water in dependence of hydrophilicity and pore
                      size. Smaller and more hydrophilic pores induce a lower
                      density in the water. In contrast to bulk water, the pair
                      distribution functions (PDFs) of confined water show a
                      splitting of the second-neighbour peak into either two, in
                      the case of smaller and more hydrophilic pores, or three
                      separate peaks, in larger and more hydrophobic pores. From
                      the running coordination number we conclude that smaller and
                      more hydrophilic confinement leads to a stronger developed
                      tetrahedral network in confined water, while confinement in
                      larger and hydrophobic pores give tetrahedral arrangements
                      that are bulk-like or even less pronounced than in bulk
                      water.},
      cin          = {FS-SMP / $XFEL_E1_MID$ / DOOR ; HAS-User},
      ddc          = {530},
      cid          = {I:(DE-H253)FS-SMP-20171124 /
                      $I:(DE-H253)XFEL_E1_MID-20210408$ /
                      I:(DE-H253)HAS-User-20120731},
      pnm          = {633 - Life Sciences – Building Blocks of Life: Structure
                      and Function (POF4-633) / 6G3 - PETRA III (DESY) (POF4-6G3)
                      / FS-Proposal: I-20200440 (I-20200440) / FS-Proposal:
                      I-20190201 (I-20190201) / DFG project 390715994 - EXC 2056:
                      CUI: Advanced Imaging of Matter (390715994) / DFG project
                      194651731 - EXC 1074: Hamburger Zentrum für ultraschnelle
                      Beobachtung (CUI): Struktur, Dynamik und Kontrolle von
                      Materie auf atomarer Skala (194651731)},
      pid          = {G:(DE-HGF)POF4-633 / G:(DE-HGF)POF4-6G3 /
                      G:(DE-H253)I-20200440 / G:(DE-H253)I-20190201 /
                      G:(GEPRIS)390715994 / G:(GEPRIS)194651731},
      experiment   = {EXP:(DE-H253)P-P02.1-20150101},
      typ          = {PUB:(DE-HGF)16},
      UT           = {WOS:001141730500001},
      doi          = {10.1021/acs.jpcc.3c06491},
      url          = {https://bib-pubdb1.desy.de/record/596100},
}