@article{13407,
  abstract     = {{<p>A study of structural evolution upon photoinduced charge transfer in a dicopper complex with biologically relevant sulfur coordination.</p>}},
  author       = {{Naumova, Maria and Khakhulin, Dmitry and Rebarz, Mateusz and Rohrmüller, Martin and Dicke, Benjamin and Biednov, Mykola and Britz, Alexander and Espinoza, Shirly and Grimm-Lebsanft, Benjamin and Kloz, Miroslav and Kretzschmar, Norman and Neuba, Adam and Ortmeyer, Jochen and Schoch, Roland and Andreasson, Jakob and Bauer, Matthias and Bressler, Christian and Schmidt, Wolf Gero and Henkel, Gerald and Rübhausen, Michael}},
  issn         = {{1463-9076}},
  journal      = {{Physical Chemistry Chemical Physics}},
  pages        = {{6274--6286}},
  title        = {{{Structural dynamics upon photoexcitation-induced charge transfer in a dicopper(i)–disulfide complex}}},
  doi          = {{10.1039/c7cp04880g}},
  year         = {{2018}},
}

@article{13422,
  author       = {{Witte, Matthias and Rohrmüller, Martin and Gerstmann, Uwe and Henkel, Gerald and Schmidt, Wolf Gero and Herres-Pawlis, Sonja}},
  issn         = {{0192-8651}},
  journal      = {{Journal of Computational Chemistry}},
  pages        = {{1752--1761}},
  title        = {{{[Cu6(NGuaS)6]2+ and its oxidized and reduced derivatives: Confining electrons on a torus}}},
  doi          = {{10.1002/jcc.24798}},
  year         = {{2017}},
}

@article{13477,
  author       = {{Witte, Matthias and Grimm-Lebsanft, Benjamin and Goos, Arne and Binder, Stephan and Rübhausen, Michael and Bernard, Martin and Neuba, Adam and Gorelsky, Serge and Gerstmann, Uwe and Henkel, Gerald and Schmidt, Wolf Gero and Herres-Pawlis, Sonja}},
  issn         = {{0192-8651}},
  journal      = {{Journal of Computational Chemistry}},
  number       = {{23-24}},
  pages        = {{2181--2192}},
  title        = {{{Optical response of the Cu2S2diamond core in Cu2II(NGuaS)2Cl2}}},
  doi          = {{10.1002/jcc.24439}},
  volume       = {{37}},
  year         = {{2016}},
}

@article{13487,
  author       = {{Witte, M. and Gerstmann, Uwe and Neuba, Adam and Henkel, G. and Schmidt, Wolf Gero}},
  issn         = {{0192-8651}},
  journal      = {{Journal of Computational Chemistry}},
  pages        = {{1005--1018}},
  title        = {{{Density functional theory of the CuA-like Cu2S2 diamond core in Cu 2II(NGuaS)2Cl2}}},
  doi          = {{10.1002/jcc.24289}},
  volume       = {{37}},
  year         = {{2016}},
}