Please note that LibreCat no longer supports Internet Explorer versions 8 or 9 (or earlier).
We recommend upgrading to the latest Internet Explorer, Google Chrome, or Firefox.
36 Publications
2015 | Journal Article | LibreCat-ID: 34307
Spura T, Elgabarty H, Kühne T. “On-the-fly” coupled cluster path-integral molecular dynamics: impact of nuclear quantum effects on the protonated water dimer. Physical Chemistry Chemical Physics. 2015;17(22):14355-14359. doi:10.1039/c4cp05192k
LibreCat
| DOI
2015 | Journal Article | LibreCat-ID: 41060
Atkins AJ, Bauer M, Jacob CR. High-resolution X-ray absorption spectroscopy of iron carbonyl complexes. Physical Chemistry Chemical Physics. 2015;17(21):13937-13948. doi:10.1039/c5cp01045d
LibreCat
| DOI
2015 | Journal Article | LibreCat-ID: 25940 | 
Weiss A, Reimer N, Stock N, Tiemann M, Wagner T. Surface-modified CAU-10 MOF materials as humidity sensors: impedance spectroscopic study on water uptake. Physical Chemistry Chemical Physics. Published online 2015:21634-21642. doi:10.1039/c5cp01988e
LibreCat
| DOI
| Download (ext.)
2014 | Journal Article | LibreCat-ID: 7485
Wiebeler C, Bader CA, Meier C, Schumacher S. Optical spectrum, perceived color, refractive index, and non-adiabatic dynamics of the photochromic diarylethene CMTE. Phys Chem Chem Phys. 2014;16(28):14531-14538. doi:10.1039/c3cp55490b
LibreCat
| DOI
2014 | Journal Article | LibreCat-ID: 34311
Watermann T, Elgabarty H, Sebastiani D. Phycocyanobilin in solution – a solvent triggered molecular switch. Phys Chem Chem Phys. 2014;16(13):6146-6152. doi:10.1039/c3cp54307b
LibreCat
| DOI
2014 | Journal Article | LibreCat-ID: 41225
Bauer M. HERFD-XAS and valence-to-core-XES: new tools to push the limits in research with hard X-rays? Phys Chem Chem Phys. 2014;16(27):13827-13837. doi:10.1039/c4cp00904e
LibreCat
| DOI
2013 | Journal Article | LibreCat-ID: 34312
Elgabarty H, Wolff M, Glaubitz A, Hinderberger D, Sebastiani D. First principles calculation of inhomogeneous broadening in solid-state cw-EPR spectroscopy. Physical Chemistry Chemical Physics. 2013;15(38). doi:10.1039/c3cp51938d
LibreCat
| DOI
2013 | Journal Article | LibreCat-ID: 41235
Atkins AJ, Bauer M, Jacob CR. The chemical sensitivity of X-ray spectroscopy: high energy resolution XANES versus X-ray emission spectroscopy of substituted ferrocenes. Physical Chemistry Chemical Physics. 2013;15(21). doi:10.1039/c3cp50999k
LibreCat
| DOI
2012 | Journal Article | LibreCat-ID: 15872
Montgomery NA, Hedley GJ, Ruseckas A, et al. Dynamics of fluorescence depolarisation in star-shaped oligofluorene-truxene molecules. Physical Chemistry Chemical Physics. 2012. doi:10.1039/c2cp24141b
LibreCat
| DOI
2011 | Journal Article | LibreCat-ID: 41987
Hikov T, Schröder CA, Cravillon J, Wiebcke M, Huber K. In situ static and dynamic light scattering and scanning electron microscopy study on the crystallization of the dense zinc imidazolate framework ZIF-zni. Phys Chem Chem Phys. 2011;14(2):511-521. doi:10.1039/c1cp22855b
LibreCat
| DOI