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Krijn, M. P. C. M., Graafsma, H., Feil, D. (1988) The influence of intermolecular interactions on the electron-density distribution. A comparison of experimental and theoretical results for α-oxalic acid dihydrate. Acta Crystallographica Section B Structural Science, 44 (6) 609-616 doi:10.1107/s0108768188005907

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Reference TypeJournal (article/letter/editorial)
TitleThe influence of intermolecular interactions on the electron-density distribution. A comparison of experimental and theoretical results for α-oxalic acid dihydrate
JournalActa Crystallographica Section B Structural Science
AuthorsKrijn, M. P. C. M.Author
Graafsma, H.Author
Feil, D.Author
Year1988 (December 1)Volume44
Issue6
PublisherInternational Union of Crystallography (IUCr)
DOIdoi:10.1107/s0108768188005907Search in ResearchGate
Generate Citation Formats
Mindat Ref. ID190202Long-form Identifiermindat:1:5:190202:4
GUID0
Full ReferenceKrijn, M. P. C. M., Graafsma, H., Feil, D. (1988) The influence of intermolecular interactions on the electron-density distribution. A comparison of experimental and theoretical results for α-oxalic acid dihydrate. Acta Crystallographica Section B Structural Science, 44 (6) 609-616 doi:10.1107/s0108768188005907
Plain TextKrijn, M. P. C. M., Graafsma, H., Feil, D. (1988) The influence of intermolecular interactions on the electron-density distribution. A comparison of experimental and theoretical results for α-oxalic acid dihydrate. Acta Crystallographica Section B Structural Science, 44 (6) 609-616 doi:10.1107/s0108768188005907
In(1988, December) Acta Crystallographica Section B Structural Science Vol. 44 (6) International Union of Crystallography (IUCr)

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Krijn, M., Feil, D. (1984) The electron-density distribution in the hydrogen bond: quantum chemical calculations; comparison with diffraction results of oxalic acid. Acta Crystallographica Section A Foundations of Crystallography, 40. doi:10.1107/s0108767384095143
Krijn, M. P. C. M., Feil, D. (1988) Electron density distributions in hydrogen bonds: A local density‐functional study of α‐oxalic acid dihydrate and comparison with experiment. The Journal of Chemical Physics, 89 (7). 4199-4208 doi:10.1063/1.454855
Stevens, E. D. (1980) Comparison of theoretical and experimental electron density distributions of oxalic acid dihydrate. Acta Crystallographica Section B Structural Crystallography and Crystal Chemistry, 36 (8) 1876-1886 doi:10.1107/s056774088000739x
Dam, J., Harkema, S., Feil, D. (1981) An electron density study of α-oxalic acid dihydrate. Acta Crystallographica Section A Foundations of Crystallography, 37. doi:10.1107/s0108767381095494
Dam, J., Harkema, S., Feil, D. (1983) The electron density of α-oxalic acid dihydrate at 100 K by X-ray diffraction: a contribution to the IUCr Commission on Charge, Spin and Momentum Densities project on the accurate determination of electron densities. Acta Crystallographica Section B Structural Science, 39 (6) 760-768 doi:10.1107/s0108768183003377
Velders, G. J. M., Feil, D. (1989) Calculation of the electron density distribution in silicon by the density-functional method. Comparison with X-ray results. Acta Crystallographica Section B Structural Science, 45 (4) 359-364 doi:10.1107/s0108768189003782
Stevens, E. D., Coppens, P. (1980) Experimental electron density distributions of hydrogen bonds. High-resolution study of α-oxalic acid dihydrate at 100 K. Acta Crystallographica Section B Structural Crystallography and Crystal Chemistry, 36 (8) 1864-1876 doi:10.1107/s0567740880007388
Michell, D., Smith, A. P., Sabine, T. M. (1969) The dislocation arrangement in α-oxalic acid dihydrate. Acta Crystallographica Section B Structural Crystallography and Crystal Chemistry, 25 (12) 2458-2460 doi:10.1107/s0567740869005930
Coppens(Project Reporter), P., Dam, J., Harkema, S., Feil, D., Feld, R., Lehmann, M. S., Goddard, R., Krüger, C., Hellner, E., Johansen, H., Larsen, F. K., Koetzle, T. F., McMullan, R. K., Maslen, E. N., Stevens, E. D. (1984) Project on comparison of structural parameters and electron density maps of oxalic acid dihydrate. Acta Crystallographica Section A Foundations of Crystallography, 40 (3). 184-195 doi:10.1107/s0108767384000428
Harkema, S., van Hummel, G., Feil, D. (1984) The electron-density distribution of the oxalic acid molecule in various crystalline environments. Acta Crystallographica Section A Foundations of Crystallography, 40. doi:10.1107/s0108767384094915
Coppens, P. (1981) Survey of results on oxalic acid dihydrate. Acta Crystallographica Section A Foundations of Crystallography, 37. doi:10.1107/s0108767381095871
 
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