Powder Diffraction Journal
Volume 36 – 2021
Powder Diffraction Journal
Powder Diffraction – Vol. 36 Number 1 – March 2021
Abstracts, Editorials, and International Reports from Powder Diffraction are now available online free of charge. To view the abstracts with option to purchase articles or login if you have a subscription, please visit Cambridge Journals Online.
Editorial
Camden Hubbard
Editorial (p. 1)
DOI: 10.1017/S0885715621000075
Technical Article
Analio J. Dugarte-Dugarte, Jacco van de Streek, Graciela Díaz de Delgado, Alicja Rafalska-Lasocha, José Miguel Delgado
Crystal structure from laboratory X-ray powder diffraction data, DFT-D calculations, Hirshfeld surface analysis, and energy frameworks of a new polymorph of 1-benzothiophene-2-carboxylic acid
(pp. 2 – 13)
DOI: 10.1017/S0885715620000755
P. Mikula, M. Vrána, J. Šaroun, V. Ryukhtin
Observation of multiple Bragg reflections accompanying forbidden Si(002) reflection in bent-perfect Si crystal (pp. 14 – 19)
DOI: 10.1017/S0885715620000779
New Diffraction Data
José H. Quintana Mendoza, Andrea P. Aparicio, J. A. Henao
Powder diffraction data and preliminary spectroscopic and thermal characterization of pinaverium bromide, a drug used for functional gastrointestinal disorders (pp. 20 – 24)
DOI: 10.1017/S088571562000072X
Ji Yang, Zhi Hua Liu, Rui Zhi Zhu, Neng Jun Xiang, Shi Yun Tang, Pei He, Zi Li Suo, Hui Li
X-ray powder diffraction data for nicotine 3,5-dihydroxybenzoate dihydrate, C10H15N2·C7H5O4·2H2O (pp. 25 – 28)
DOI: 10.1017/S0885715621000014
Mariana M. V. M. Souza, Alex Maza, Pablo V. Tuza
X-ray powder diffraction data of LaNi0.5Ti0.45Co0.05O3, LaNi0.45Co0.05Ti0.5O3, and LaNi0.5Ti0.5O3 perovskites (pp. 29 – 34)
DOI: 10.1017/S0885715620000767
Shivang Bhaskar, Joseph T. Golab, James A. Kaduk, Amy M. Gindhart, Thomas N. Blanton
Crystal structure of pimecrolimus Form B, C43H68ClNO11 (pp. 35 – 42)
DOI: 10.1017/S088571562100004X
Jerry Hong, Joseph T. Golab, James A. Kaduk, Amy M. Gindhart,
Thomas N. Blanton
Crystal structure of (E)-doxepin hydrochloride, C19H22NOCl (pp. 43 – 49)
DOI: 10.1017/S0885715621000063
James A. Kaduk, Amy M. Gindhart, Thomas N. Blanton
Crystal structure of loteprednol etabonate Form II, C24H31ClO7 (pp. 50 – 55)
DOI: 10.1017/S0885715621000038
James A. Kaduk, Amy M. Gindhart, Thomas N. Blanton
Crystal structure of tezacaftor Form A, C26H27F3N2O6 (pp. 56 – 62)
DOI: 10.1017/S0885715621000051
Data Report
James A. Kaduk, Amy M. Gindhart, Thomas N. Blanton
Powder X-ray diffraction of azelastine hydrochloride, C22H25ClN3O·Cl (pp. 63 – 64)
DOI: 10.1017/S0885715620000664
Jingwen Fan, Zhicheng Zha, Qing Wang, Shoujun Zheng
X-ray powder diffraction data for norethisterone enanthate, C27H38O3 (pp. 65 – 67)
DOI: 10.1017/S0885715620000743
James A. Kaduk, Amy M. Gindhart, Thomas N. Blanton
Powder X-ray diffraction of escitalopram oxalate oxalic acid hydrate, (C20H21FN2O)2(C2O4)(H2C2O4)(H2O)0.16 (pp. 68 – 69)
DOI: 10.1017/S0885715621000026
Calendars of Meetings, Short Courses and Workshops
Gang Wang
Calendar of Forthcoming Meetings (p. 70)
DOI: 10.1017/S0885715620000780
Gang Wang
Calendar of Short Courses and Workshops (p. 71)
DOI: 10.1017/S0885715620000792
Erratum
“On the Cover” — Erratum (p. 72)
DOI: 10.1017/S0885715621000191
Powder Diffraction – Vol. 36 Number 2 – June 2021
Abstracts, Editorials, and International Reports from Powder Diffraction are now available online free of charge. To view the abstracts with option to purchase articles or login if you have a subscription, please visit Cambridge Journals Online.
Editorial
Camden Hubbard
Hope for recovery from the pandemic is appearing, (p. 73)
▸ DOI: 10.1017/S0885715621000312
PROCEEDINGS PAPERS
Ichikawa, S., Miyamoto, K., & Kurisaki, T.
Preliminary examination for revealing the provenance dependency of the lattice spacing of biotite for the provenance estimation of Atamadai-type pottery (2500–1500 BC) by XRD, (pp. 74-77)
▸ DOI: 10.1017/S0885715621000178
Brian K. Tanner, Patrick J. McNally and Andreas N. Danilewsky
X-ray imaging of silicon die within fully packaged semiconductor devices, (pp. 78-84)
▸ DOI: 10.1017/S088571562100021X
New Diffraction Data
Patel, N. V., Golab, J. T., Kaduk, J. A., Gindhart, A. M., & Blanton, T. N.
Crystal structure of tamsulosin hydrochloride, C20H29N2O5SCl, (pp. 85-91)
▸ DOI: 10.1017/S0885715621000129
Kaduk, J. A., Gindhart, A. M., & Blanton, T. N.
Crystal structure of tofacitinib dihydrogen citrate (Xeljanz®), (C16H21N6O)(H2C6H5O7), (pp. 92-99)
▸ DOI: 10.1017/S0885715621000105
Kaduk, J. A., Gindhart, A. M., & Blanton, T. N.
Crystal structure of eltrombopag olamine Form I, (C2H8NO)2 (C25H20N4O4), (pp. 100-106)
▸ DOI: 10.1017/S0885715621000099
Kaduk, J. A., Gindhart, A. M., & Blanton, T. N.
Crystal structure of edoxaban tosylate monohydrate Form I, (C24H31ClN7O4S)(C7H7O3S)(H2O), (pp. 107-113)
▸ DOI: 10.1017/S0885715621000117
Kaduk, J. A., Gindhart, A. M., & Blanton, T. N.
Crystal structure of pomalidomide Form I, C13H11N3O4, (pp. 114–119)
▸ DOI: 10.1017/S0885715621000087
Kaduk, J. A.
Crystal structure of strontium hydrogen citrate monohydrate, Sr(HC6H5O7)(H2O)), (pp. 120–128)
▸ DOI: 10.1017/S0885715621000166
Zhou, J., Chai, C., Hao, M., & Zhong, X.
Synthesis, crystal structure, and X-ray diffraction data of lithium m-phenylenediamine sulfate Li2(C6H10N2)(SO4)2, (pp. 129-133)
▸ DOI: 10.1017/S0885715621000221
Data Report
Dmitrienko, A. O., Konnov, A. A., & Klenov, M. S.
Crystal structure of 3,3′-(E)-diazene-1,2-diylbis{4-[(3,4-dinitro-1H-pyrazol-1-yl)-NNO-azoxy]-1,2,5-oxadiazole}, (pp. 134-139)
▸ DOI: 10.1017/S0885715621000208
Lin, X., Chen, D.-dan, Lin, X.-hui, Liu, A.-tao, Zong, B., & Zou, L.-jia
X-ray powder diffraction data for N,N-dimethyl-1H-benzo[d]imidazol-2-amine, C9H11N3, (pp. 140-142)
▸ DOI: 10.1017/S088571562100018X
INTERNATIONAL REPORT
S. Jennings and D. Zulli
2021 ICDD® Annual Spring Meetings – a virtual zoom event 8–12 March 2021, (pp. 143-144)
▸ DOI: 10.1017/S0885715621000324
Calendars of Meetings, Short Courses and Workshops
Gang Wang
Calendar of Forthcoming Meetings, (p. 145)
▸ DOI: 10.1017/S0885715621000257
Gang Wang
Calendar of Short Courses and Workshops, (p. 146)
▸ DOI: 10.1017/S0885715621000269
Powder Diffraction – Vol. 36 Number 3 – September 2021
Abstracts, Editorials, and International Reports from Powder Diffraction are now available online free of charge. To view the abstracts with option to purchase articles or login if you have a subscription, please visit Cambridge Journals Online.
Editorial
Camden Hubbard
Editorial (p. 147)
▸ DOI: 10.1017/S0885715621000452
Technical Article
Carina Schlesinger, Edith Alig, Martin U. Schmidt
Crystal Structure of the Anticancer Drug Carmustine Determined by X-ray Powder Diffraction (pp. 148–50)
▸ DOI: 10.1017/S0885715621000294
W. Wong-Ng, J. Guo, Y. Yan, J. A. Kaduk
Structural and Thermoelectric Properties of Pb4In2.6Bi3.4Se13 (pp. 151–58)
▸ DOI: 10.1017/S0885715621000385
Review Article
Hideo Toraya
Review of the Direct Derivation Method: Quantitative Phase Analysis with Observed Intensities and Chemical Composition Data (pp. 159–68)
▸ DOI: 10.1017/S0885715621000373
Proceedings Paper
Takashi Ida
Equatorial Aberration for Powder Diffraction Data Collected by Continuous-Scan Integration of a Silicon Strip X-ray Detector (pp. 169–75)
▸ DOI: 10.1017/S0885715621000403
New Diffraction Data
A. O. Dmitrienko, A. A. Konnov, M. S. Klenov
Crystal Structure of 3-[(3,4-Dinitro-1H-Pyrazol-1-Yl)-NNO-Azoxy]-4-Nitro-1,2,5-Oxadiazole (pp. 176–80)
▸ DOI: 10.1017/S0885715621000233
James A. Kaduk, Amy M. Gindhart, Thomas N. Blanton
Crystal Structure of Levocetirizine Dihydrochloride Form I, C21H27ClN2O3Cl2 (pp. 181–89)
▸ DOI: 10.1017/S0885715621000245
Joel W. Reid
Powder X-ray Diffraction Data for Dimethylarsinic Acid, (CH3)2AsO(OH) (pp. 190–195)
▸ DOI: 10.1017/S0885715621000270
James A. Kaduk, Amy M. Gindhart, Thomas N. Blanton
Crystal Structure of Palbociclib Isethionate Form B, (C24H30N7O2)(C2H5O4S) (pp. 196–201)
▸ DOI: 10.1017/S0885715621000361
Data Report
James A. Kaduk, Amy M. Gindhart, Thomas N. Blanton
Powder X-ray Diffraction of Varenicline Hydrogen Tartrate Form B (Chantix®), (C13H14N3)(HC4H4O6) (pp. 202–04)
▸ DOI: 10.1017/S088571562100035X
James A. Kaduk, Amy M. Gindhart, Thomas N. Blanton
Powder X-ray Diffraction of Pazopanib Hydrochloride Form 1, C21H24N7O2SCl (pp. 205–07)
▸ DOI: 10.1017/S0885715621000282
Ryan L. Hodge, James A. Kaduk, Amy M. Gindhart, Thomas N. Blanton
Powder X-ray Diffraction of Daclatasvir Dihydrochloride Form N-2 (Daklinza®), C40H52N8O6Cl2 (pp. 208–11)
▸ DOI: 10.1017/S0885715621000397
Crystallography Education Note
Stephanie Jennings
ICDD® InSession: Mastering the PDF® Database and JADE® Software (p. 212)
▸ DOI: 10.1017/S0885715621000464
Calendars of Meetings, Short Courses and Workshops
Gang Wang
Calendar of Forthcoming Meetings (p. 213)
▸ DOI: 10.1017/S0885715621000440
Gang Wang
Calendar of Short Courses and Workshops (p. 214)
▸ DOI: 10.1017/S0885715621000439
Addendum
Yali Su, Dayong Lu, Shan Wang
Characterization and Rietveld Refinements of New Dense Ceramics Ba3−xSrxTb3−xCexO9 (x = 1 and 1.5) Perovskites – ADDENDUM (p. 215)
▸ DOI: 10.1017/S0885715620000470
G. Murugesan, R. Nithya, S. Kalainathan
Rietveld Refinement of Sm0.55Sr0.45Mn0.4Fe0.6O3 – ADDENDUM (p. 216)
▸ DOI: 10.1017/S0885715620000482
Corrigendum
W. Wong-Ng, G. Y. Liu, D. D. Shi, Y. Q. Yang, R. Derbeshi, D. Windover, J. A. Kaduk
Crystal Chemistry, X-ray Diffraction Reference Patterns, and Bandgap Studies for (BaxSr1-x)2CoWO6 (x = 0.1, 0.2, 0.3, 0.5, 0.7, and 0.9) – CORRIGENDUM (p. 217)
▸ DOI: 10.1017/S0885715621000130
Erratum
Gerald Falkenberg, Frank Seiboth, Frieder Koch, Ken Vidar Falch, Andreas Schropp, Dennis Brückner, Jan Garrevoet
CRL Optics and Silicon Drift Detector for P06 Microprobe Experiments at 35 KeV — ERRATUM (p. 218)
▸ DOI: 10.1017/S0885715620000731
Analio J. Dugarte-Dugarte, Jacco van de Streek, Graciela Díaz de Delgado, Alicja Rafalska-Lasocha, José Miguel Delgado
Crystal Structure from Laboratory X-ray Powder Diffraction Data, DFT-D Calculations, Hirshfeld Surface Analysis, and Energy Frameworks of a New Polymorph of 1-Benzothiophene-2-Carboxylic Acid — ERRATUM (p. 219)
▸ DOI: 10.1017/S0885715621000300