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270. “Correlation between intramolecular bond lengths and K-shell σ-shape resonances in
gas-phase molecules”, Sette, F.; Stöhr, J.; Hitchcook, A. P. Chem. Phys. Lett., 1984, 110,
517–520
271. “Shape resonances of oriented molecules: ab initio theory and experiment on hydrocarbon
molecules”, Haack, N.; Ceballos, G.; Wende, H.; Baberschke, K.; Arvanitis, D.; Ankudinov,
A. L.; Rehr, J. J. Phys. Rev. Lett., 2000, 84, 614–617
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273. StoBe, http://www.fhi-berlin.mpg.de/KHsoftware/StoBe/StoBeMAN.html
274. “X-ray magnetic circular dichroism—A versatile tool to study magnetism”, van der Laan, G.;
Figueroa, A. I. Coord. Chem. Rev., 2014, 277, 95–129
275. “Comparison of X-ray absorption spectra between water and ice: New ice data with low
pre-edge absorption cross-section”, Sellberg, J. A.; Kaya, S.; Segtnan, V. H.; Chen, C.;
Tyliszczak, T.; Ogasawara, H.; Nordlund, D.; Pettersson, L. G. M.; Nilsson, A. J. Chem.
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276. “A proposal for the structure of high- and low-density fluctuations in liquid water”, Camisasca,
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151, 034508
277. “X-ray emission spectroscopy of hydrogen bonding and electronic structure of liquid water”,
Guo, J. H.; Luo, Y.; Augustsson, A.; Rubensson, J. E.; Sathe, C.; Agren, H.; Siegbahn, H.;
Nordgren, J. Phys. Rev. Lett., 2002, 89
278. “X-ray Raman Spectroscopy at the Oxygen K-Edge of Water and Ice: Implications on Local
Structural Models”, Bergmann, U.; Wernet, P.; Glatzel, P.; Cavalleri, M.; Pettersson, L. G. M.;
Nilsson, A.; Cramer, S. P. Phys. Rev. B, 2002, 6, 2104–2107
279. “Compatibility of quantitative X-ray spectroscopy with continuous distribution models of
water at ambient conditions”, Niskanen, J.; Fondell, M.; Sahle, C. J.; Eckert, S.; Jay, R. M.;
Gilmore, K.; Pietzsch, A.; Dantz, M.; Lu, X.; McNally, D. E.; Schmitt, T.; Vaz da Cruz, V.;
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280. “Electronic structure of silicon nitride”, Gritsenko, V. A. Phys. Uspek., 2012, 55, 498–507
281. “First-principles study of gamma-Si 3 N 4 with generalized gradient approximation and local
density approximation”, Ding, Y. C.; Zhou, H. P.; Xu, M.; Shen, Y. B.; Chen, Q. Y.; Zhu,
W. J.; He, H. L. Int. J. Mod. Phys. B, 2008, 22, 2155–2165
282. “Solid state calculations using WIEN2k”, Schwarz, K.; Blaha, P. Comp. Mat. Sci., 2003, 28,
259–273
283. “Multiplet effects in X-ray spectroscopy”, de Groot, F. Coord. Chem. Rev., 2005, 249, 31–63
284. “Ligand Field Strengths and Oxidation States from Manganese L-Edge Spectroscopy”,
Cramer, S. P.; Degroot, F. M. F.; Ma, Y.; Chen, C. T.; Sette, F.; Kipke, C. A.; Eichhorn,
D. M.; Chan, M. K.; Armstrong, W. H.; Libby, E.; Christou, G.; Brooker, S.; Mckee, V.;
Mullins, O. C.; Fuggle, J. C. J. Am. Chem. Soc., 1991, 113, 7937–7940
285. de Groot, F. M. F.; Kotani, A. Core Level Spectroscopy of Solids; CRC Press: Boca Raton,
2008
286. “Calculation of Multiplet Structure of Core p-vacancy Levels. II”, Gupta, R. P.; Sen, S. K.
Phys. Rev. B, 1975, 12, 15–19
287. “Multiplet Structure in X-Ray P-Shell Photoelectron and K-Emission Spectra of Nickel
Compounds”, Asada, S.; Satako, C.; Sugano, S. J. Phys. Soc. Japan, 1975, 37, 855
288. “Multiplet Structure in the L 2,3 X-Ray Absorption Spectra: A Fingerprint for High- and
Low-spin Ni
2+ Compounds”, van der Laan, G.; Thole, B. T.; Sawatzky, G. A.; Verdaguer,
M. Phys. Rev. B, 1988, 37, 6587–6589
289. Butler, P. H. Point Group Symmetry. Applications, Methods and Tables; Plenum: New York,
1981
290. Cowan, R. D. The Theory of Atomic Structure and Spectra; University of California Press:
Berkeley, 1981
366
References