The Structure of the First Coordination Shell in Liquid Water

Science

Volumn 304, Issue 5673, 2004, Pages 995-999

  Wernet, Ph ^a,b   Nordlund, D ^c   Bergmann, U ^a   Cavalleri, M ^c   Odelius, N ^c   Ogasawara, H ^a,c   Naslund L A ^a,c   Hirsch, T K ^c   Ojamae L ^d   Glatzel, P ^e   Pettersson, L G M ^c   Nilsson, A ^a,c  

^a SLAC NATIONAL ACCELERATOR LABORATORY   (United States)

^b HAHN MEITNER INSTITUT   (Germany)

^c STOCKHOLM UNIVERSITY   (Sweden)

^d LINKÖPING UNIVERSITY   (Sweden)

^e UTRECHT UNIVERSITY   (Netherlands)

Author keywords

[No Author keywords available]

Indexed keywords

ABSORPTION SPECTROSCOPY; COMPUTER SIMULATION; HEATING; HYDROGEN BONDS; MOLECULAR DYNAMICS; RAMAN SCATTERING; X RAY DIFFRACTION ANALYSIS; X RAY SPECTROSCOPY;

LOCAL STRUCTURE DISTRIBUTIONS; TETRAHEDRAL STRUCTURES;

FLUID MECHANICS;

COORDINATION COMPOUND; ICE; WATER;

STRUCTURAL ANALYSIS; WATER;

ABSORPTION SPECTROSCOPY; ARTICLE; CALCULATION; CHEMICAL INTERACTION; CHEMICAL STRUCTURE; CONFORMATIONAL TRANSITION; HEATING; HYDROGEN BOND; LIQUID; MOLECULAR DYNAMICS; MOLECULAR PROBE; NEUTRON DIFFRACTION; PRIORITY JOURNAL; QUANTUM CHEMISTRY; RAMAN SPECTROMETRY; ROENTGEN SPECTROSCOPY; SIMULATION; STRUCTURE ANALYSIS; SURFACE PROPERTY; TECHNIQUE; TEMPERATURE DEPENDENCE; X RAY DIFFRACTION; CHEMICAL MODEL; CHEMISTRY; COMPUTER SIMULATION; PHYSICAL CHEMISTRY; SPECTROSCOPY; TEMPERATURE;

CHEMISTRY, PHYSICAL; COMPUTER SIMULATION; HYDROGEN BONDING; ICE; MODELS, CHEMICAL; MOLECULAR STRUCTURE; SPECTRUM ANALYSIS; SPECTRUM ANALYSIS, RAMAN; TEMPERATURE; WATER;

EID: 2342558053     PISSN: 00368075     EISSN: None     Source Type: Journal    
DOI: 10.1126/science.1096205     Document Type: Article

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30. Supported by the Swedish Foundation for Strategic Research, Swedish Natural Science Research Council, and U.S. National Science Foundation grant CHE-0089215. Generous grants of computer time at the swedish National Supercomputer Center and the Center for Parallel Computing are gratefully acknowledge. Portions of this research were carried out at the Stanford Synchrotron Radiation Laboratory, a national user facility operated by Stanford University on behalf of the U.S. Department of Energy, Office of Basic Energy Sciences. Use of the Advanced Photon Source (APS) was supported by the U.S. Department of Energy, Basic Energy Sciences, Office of Sciences under contract No. W-31-109-ENG-38. Biophysics Collaborative Access Team (BioCAT) is a National Institutes of Health-supported Research Center RR-08630 The Advanced Light Source (ALS) is supported by the Director, Office of Science, Office of Basic Energy Sciences, Materials Sciences Division, of the U.S. Department of Energy under Contract No. DE-AC03-76SF00098 at Lawrence Berkeley National Laboratory. Assistance by the APS, ALS, and the Swedish national laboratory MAX-lab staff is gratefully acknowledge. We thank J. B. Hastings for his valuable comments and discussions and S. P. Cramer for making the XRS spectrometer available.