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ACKNOWLEDGMENTS
S.E.B. and R.S.M. thank P. Vöhringer and P.J. thanks T. Jungwirth
for valuable discussions. All authors acknowledge the Helmholtz-
Zentrum Berlin for allocation of synchrotron beam time at BESSY-II.
O.M., T.M., K.B., M.C., A.G., and P.J. acknowledge the Czech
Ministry of Education, Youth and Sports for generous allocation of
supercomputer time at IT4I in Ostrava via the Large Infrastructures
for Research, Experimental Development and Innovations project
IT4Innovations National Supercomputing Center–LM2015070.
Funding:P.J. thanks the European Regional Development Fund
(project ChemBioDrug no. CZ.02.1.01/0.0/0.0/16_019/0000729)
for support. O.M. and K.B. were supported by the grant Primus16/
SCI/27/247019 from Charles University. S.E.B. and R.S.M. are
supported by the U.S. National Science Foundation (CHE-1665532).
T.M. acknowledges a fellowship from the University of Chemistry
and Technology, Prague, and both T.M. and K.B. received support
from the IMPRS Dresden. R.S.M. acknowledges support from
the States of Jersey Postgraduate Bursary. R.S. received an
Emmy-Noether grant (no. SE 2253/3-1) from the Deutsche
Forschungsgemeinschaft. B.W. acknowledges support from the
Max-Planck-Gesellschaft. S.T. acknowledges support from JSPS
KAKENHI grant no. JP18K14178. H.A. thanks the Egyptian Ministry
of Higher Education and Ain Shams University for her Ph.D.
grant and the Egyptian Culture Office in Berlin for support. P.E.M.
acknowledges support from his YouTube popular science channel
Thunderf00t.Author contributions:T.B., P.E.M., R.S.M., H.C.S.,
B.W., S.E.B., and P.J. designed the experiment and, together with
R.S., H.A., D.H., G.W., and K.B., performed the measurements
at the BESSY II synchrotron. S.T. assisted with data analysis.
O.M., T.M., and P.J. designed the computational approach.
T.M., K.B., M.C., and A.G. performed the calculations. P.J., B.W.,
and S.E.B. wrote the manuscript, with comments from all
authors.Competing interests:The authors declare no
competing interests.Data and materials availability:All data
are available in the main text or the supplementary materials or in
the Zenodo repository ( 65 ), which is freely accessible.
SUPPLEMENTARY MATERIALS
science.sciencemag.org/content/368/6495/1086/suppl/DC1
Materials and Methods
Supplementary Text
Figs. S1 to S28
References ( 66 – 92 )
9 December 2019; resubmitted 25 February 2020
Accepted 3 April 2020
10.1126/science.aaz7607
Buttersacket al.,Science 368 , 1086–1091 (2020) 5 June 2020 6of6
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