ERKALE-A flexible program package for X-ray properties of atoms and molecules
Lehtola, Jussi, Hakala, Mikko, Sakko, Arto, Hämäläinen, Keijo
Published in Journal of computational chemistry (05.07.2012)
Published in Journal of computational chemistry (05.07.2012)
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Journal Article
Microscopic structure of water at elevated pressures and temperatures
Sahle, Christoph J., Sternemann, Christian, Schmidt, Christian, Lehtola, Susi, Jahn, Sandro, Simonelli, Laura, Huotari, Simo, Hakala, Mikko, Pylkkänen, Tuomas, Nyrow, Alexander, Mende, Kolja, Tolan, Metin, Hämäläinen, Keijo, Wilke, Max
Published in Proceedings of the National Academy of Sciences - PNAS (16.04.2013)
Published in Proceedings of the National Academy of Sciences - PNAS (16.04.2013)
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Journal Article
Effect of the Hydrophobic Alcohol Chain Length on the Hydrogen-Bond Network of Water
Juurinen, Iina, Pylkkänen, Tuomas, Sahle, Christoph J, Simonelli, Laura, Hämäläinen, Keijo, Huotari, Simo, Hakala, Mikko
Published in The journal of physical chemistry. B (24.07.2014)
Published in The journal of physical chemistry. B (24.07.2014)
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Journal Article
Saturation Behavior in X‑ray Raman Scattering Spectra of Aqueous LiCl
Juurinen, Iina, Pylkkänen, Tuomas, Ruotsalainen, Kari O, Sahle, Christoph J, Monaco, Giulio, Hämäläinen, Keijo, Huotari, Simo, Hakala, Mikko
Published in The journal of physical chemistry. B (27.12.2013)
Published in The journal of physical chemistry. B (27.12.2013)
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Journal Article
Protonation Dynamics and Hydrogen Bonding in Aqueous Sulfuric Acid
Niskanen, Johannes, Sahle, Christoph J, Juurinen, Iina, Koskelo, Jaakko, Lehtola, Susi, Verbeni, Roberto, Müller, Harald, Hakala, Mikko, Huotari, Simo
Published in The journal of physical chemistry. B (03.09.2015)
Published in The journal of physical chemistry. B (03.09.2015)
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Journal Article
The isotropic Compton profile difference across the phase transition of VO2
Ruotsalainen, Kari O., Inkinen, Juho, Pylkkänen, Tuomas, Buslaps, Thomas, Hakala, Mikko, Hämäläinen, Keijo, Huotari, Simo
Published in The European physical journal. B, Condensed matter physics (2018)
Published in The European physical journal. B, Condensed matter physics (2018)
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Journal Article
Intramolecular structure and energetics in supercooled water down to 255 K
Lehmkühler, Felix, Forov, Yury, Büning, Thomas, Sahle, Christoph J, Steinke, Ingo, Julius, Karin, Buslaps, Thomas, Tolan, Metin, Hakala, Mikko, Sternemann, Christian
Published in Physical chemistry chemical physics : PCCP (2016)
Published in Physical chemistry chemical physics : PCCP (2016)
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Journal Article
Probing the thermal stability and the decomposition mechanism of a magnesium-fullerene polymer via X-ray Raman spectroscopy, X-ray diffraction and molecular dynamics simulations
Aramini, Matteo, Niskanen, Johannes, Cavallari, Chiara, Pontiroli, Daniele, Musazay, Abdurrahman, Krisch, Michael, Hakala, Mikko, Huotari, Simo
Published in Physical chemistry chemical physics : PCCP (2016)
Published in Physical chemistry chemical physics : PCCP (2016)
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Journal Article
Temperature-Induced Structural Changes of Tetrahydrofuran Clathrate and of the Liquid Water/Tetrahydrofuran Mixture
Lehmkühler, Felix, Sakko, Arto, Steinke, Ingo, Sternemann, Christian, Hakala, Mikko, Sahle, Christoph J, Buslaps, Thomas, Simonelli, Laura, Galambosi, Szabolcs, Paulus, Michael, Pylkkänen, Tuomas, Tolan, Metin, Hämäläinen, Keijo
Published in Journal of physical chemistry. C (03.11.2011)
Published in Journal of physical chemistry. C (03.11.2011)
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Journal Article
Anomalous Energetics in Tetrahydrofuran Clathrate Hydrate Revealed by X-ray Compton Scattering
Lehmkühler, Felix, Sakko, Arto, Sternemann, Christian, Hakala, Mikko, Nygård, Kim, Sahle, Christoph J, Galambosi, Szabolcs, Steinke, Ingo, Tiemeyer, Sebastian, Nyrow, Alexander, Buslaps, Thomas, Pontoni, Diego, Tolan, Metin, Hämäläinen, Keijo
Published in The journal of physical chemistry letters (07.10.2010)
Published in The journal of physical chemistry letters (07.10.2010)
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Journal Article