Works matching IS 00218898 AND DT 2021 AND VI 54 AND IP 3

Results: 34

Multipurpose diffractometer for in situ X‐ray crystallography of functional materials.

Published in:

Journal of Applied Crystallography, 2021, v. 54, n. 3, p. 914, doi. 10.1107/S1600576721004088

By:

Gorfman, Semën;
Spirito, David;
Cohen, Netanela;
Siffalovic, Peter;
Nadazdy, Peter;
Li, Youli

Publication type:

Article

Combined specular and off‐specular reflectometry: elucidating the complex structure of soft buried interfaces.

Published in:

Journal of Applied Crystallography, 2021, v. 54, n. 3, p. 924, doi. 10.1107/S1600576721003575

By:

Hafner, Aljoša;
Gutfreund, Philipp;
Toperverg, Boris P.;
Jones, Andrew O. F.;
de Silva, Johann P.;
Wildes, Andrew;
Fischer, Henry E.;
Geoghegan, Mark;
Sferrazza, Michele

Publication type:

Article

X‐ray scattering profiles: revealing the porosity gradient in porous silicon.

Published in:

Journal of Applied Crystallography, 2021, v. 54, n. 3, p. 847, doi. 10.1107/S1600576721003484

By:

Romanitan, Cosmin;
Varasteanu, Pericle;
Culita, Daniela C.;
Bujor, Alexandru;
Tutunaru, Oana

Publication type:

Article

Quantifying the robustness of the neutron reflectometry technique for structural characterization of polymer brushes.

Published in:

Journal of Applied Crystallography, 2021, v. 54, n. 3, p. 739, doi. 10.1107/S160057672100251X

By:

Gresham, Isaac J.;
Murdoch, Timothy J.;
Johnson, Edwin C.;
Robertson, Hayden;
Webber, Grant B.;
Wanless, Erica J.;
Prescott, Stuart W.;
Nelson, Andrew R. J.

Publication type:

Article

SHELIXIR: automation of experimental phasing procedures using SHELXC/D/E.

Published in:

Journal of Applied Crystallography, 2021, v. 54, n. 3, p. 996, doi. 10.1107/S1600576721002454

By:

Kolenko, Petr;
Stránský, Jan;
Koval', Tomáš;
Malý, Martin;
Dohnálek, Jan

Publication type:

Article

A novel method to obtain integral parameters of the orientation distribution function of textured polycrystals from wavelength‐resolved neutron transmission spectra.

Published in:

Journal of Applied Crystallography, 2021, v. 54, n. 3, p. 903, doi. 10.1107/S1600576721003861

By:

Vicente Alvarez, Miguel Angel;
Laliena, Victor;
Malamud, Florencia;
Campo, Javier;
Santisteban, Javier

Publication type:

Article

Structure determination of organic compounds by a fit to the pair distribution function from scratch without prior indexing.

Published in:

Journal of Applied Crystallography, 2021, v. 54, n. 3, p. 776, doi. 10.1107/S1600576721002569

By:

Schlesinger, Carina;
Habermehl, Stefan;
Prill, Dragica

Publication type:

Article

Grazing‐incidence X‐ray scattering of lamellar thin films. Erratum.

Published in:

Journal of Applied Crystallography, 2021, v. 54, n. 3, p. 1024, doi. 10.1107/S1600576721002971

By:

Smilgies, Detlef-M.

Publication type:

Article

The effect of data quality and model parameters on the quantitative phase analysis of X‐ray diffraction data by the Rietveld method.

Published in:

Journal of Applied Crystallography, 2021, v. 54, n. 3, p. 878, doi. 10.1107/S160057672100371X

By:

Rowles, Matthew R.

Publication type:

Article

CrystalExplorer: a program for Hirshfeld surface analysis, visualization and quantitative analysis of molecular crystals.

Published in:

Journal of Applied Crystallography, 2021, v. 54, n. 3, p. 1006, doi. 10.1107/S1600576721002910

By:

Spackman, Peter R.;
Turner, Michael J.;
McKinnon, Joshua J.;
Wolff, Stephen K.;
Grimwood, Daniel J.;
Jayatilaka, Dylan;
Spackman, Mark A.

Publication type:

Article

A high‐throughput assembly of beam‐shaping channel‐cut monochromators for laboratory high‐resolution X‐ray diffraction and small‐angle X‐ray scattering experiments.

Published in:

Journal of Applied Crystallography, 2021, v. 54, n. 3, p. 730, doi. 10.1107/S1600576721002338

By:

Nadazdy, Peter;
Hagara, Jakub;
Mikulik, Petr;
Zaprazny, Zdenko;
Korytar, Dusan;
Majkova, Eva;
Jergel, Matej;
Siffalovic, Peter

Publication type:

Article

Detailed total scattering analysis of disorder in ZIF‐8.

Published in:

Journal of Applied Crystallography, 2021, v. 54, n. 3, p. 759, doi. 10.1107/S1600576721002843

By:

Metz, Peter C.;
Purdy, Stephen C.;
Ryder, Matthew R.;
Ganesan, Arvind;
Nair, Sankar;
Page, Katharine

Publication type:

Article

A polarization‐switch effect of silicon crystals under multiple‐beam diffraction geometry.

Published in:

Journal of Applied Crystallography, 2021, v. 54, n. 3, p. 976, doi. 10.1107/S1600576721002582

By:

Tang, Zheng;
Zheng, Lirong;
Chu, Shengqi;
An, Pengfei;
Huang, Xianrong;
Hu, Tiandou;
Assoufid, Lahsen

Publication type:

Article

Quantitative texture analysis using the NOMAD time‐of‐flight neutron diffractometer.

Published in:

Journal of Applied Crystallography, 2021, v. 54, n. 3, p. 867, doi. 10.1107/S1600576721003022

By:

Peterson, N. E.;
Einhorn, J. R.;
Fancher, C. M.;
Bunn, J. R.;
Payzant, E. A.;
Agnew, S. R.

Publication type:

Article

Ekkehart Tillmanns (1941–2020).

Published in:

Journal of Applied Crystallography, 2021, v. 54, n. 3, p. 1027, doi. 10.1107/S1600576721004398

By:

Paufler, Peter;
Meyer, Dirk C.

Publication type:

Article

Alignment facility and software for single‐crystal time‐of‐flight neutron spectroscopy.

Published in:

Journal of Applied Crystallography, 2021, v. 54, n. 3, p. 957, doi. 10.1107/S1600576721004234

By:

Liu, Zihao;
Lane, Harry;
Frost, Christopher D.;
Ewings, Russell A.;
Attfield, J. Paul;
Stock, Chris

Publication type:

Article

Robust surface structure analysis with reliable uncertainty estimation using the exchange Monte Carlo method. Corrigendum.

Published in:

Journal of Applied Crystallography, 2021, v. 54, n. 3, p. 1023, doi. 10.1107/S1600576721004520

By:

Nagai, Kazuki;
Anada, Masato;
Nakanishi-Ohno, Yoshinori;
Okada, Masato;
Wakabayashi, Yusuke

Publication type:

Article

Crystallographic analysis of the lattice metric (CALM) from single electron backscatter diffraction or transmission Kikuchi diffraction patterns.

Published in:

Journal of Applied Crystallography, 2021, v. 54, n. 3, p. 1012, doi. 10.1107/S1600576721004210

By:

Nolze, Gert;
Tokarski, Tomasz;
Rychłowski, Łukasz;
Cios, Grzegorz;
Winkelmann, Aimo

Publication type:

Article

Investigation of precision, accuracy and confidence of X‐ray diffraction for determining crystallite size in nanopowders.

Published in:

Journal of Applied Crystallography, 2021, v. 54, n. 3, p. 856, doi. 10.1107/S1600576721002922

By:

Moore, Alexander P.;
Nemer, Martin B.;
Rodriguez, Mark A.;
Roberts, Christine C.;
Fleig, Patrick F.;
Papenguth, Hans W.

Publication type:

Article

A combined approach to characterize ligand‐induced solid–solid phase transitions in biomacromolecular crystals.

Published in:

Journal of Applied Crystallography, 2021, v. 54, n. 3, p. 787, doi. 10.1107/S1600576721003137

By:

Ramakrishnan, Saminathan;
Stagno, Jason R.;
Magidson, Valentin;
Heinz, William F.;
Wang, Yun-Xing

Publication type:

Article

On the use of the scattering amplitude in coherent X‐ray Bragg diffraction imaging.

Published in:

Journal of Applied Crystallography, 2021, v. 54, n. 3, p. 797, doi. 10.1107/S1600576721003113

By:

Godard, Pierre

Publication type:

Article

Incommensurately modulated structure zone in α‐Zr instigated by the drag force on a grain boundary.

Published in:

Journal of Applied Crystallography, 2021, v. 54, n. 3, p. 982, doi. 10.1107/S1600576721003605

By:

Zhang, Yingdong;
Li, Geping;
Yuan, Fusen;
Han, Fuzhou;
Ali, Muhammad;
Guo, Wenbin;
Ren, Jie;
Liu, Chengze;
Gu, Hengfei;
Yuan, Gaihuan

Publication type:

Article

Characterizing dislocation loops in irradiated polycrystalline Zr alloys by X‐ray line profile analysis of powder diffraction patterns with satellites.

Published in:

Journal of Applied Crystallography, 2021, v. 54, n. 3, p. 803, doi. 10.1107/S1600576721002673

By:

Ungár, Tamás;
Ribárik, Gábor;
Topping, Matthew;
Jones, Rebecca M. A.;
Dan Xu, Xiao;
Hulse, Rory;
Harte, Allan;
Tichy, Géza;
Race, Christopher P.;
Frankel, Philipp;
Preuss, Michael

Publication type:

Article

Aerosol‐based ligand soaking of reservoir‐free protein crystals.

Published in:

Journal of Applied Crystallography, 2021, v. 54, n. 3, p. 895, doi. 10.1107/S1600576721003551

By:

Ross, Breyan;
Krapp, Stephan;
Geiss-Friedlander, Ruth;
Littmann, Walter;
Huber, Robert;
Kiefersauer, Reiner

Publication type:

Article

ASAXS measurements on ferritin and apoferritin at the bioSAXS beamline P12 (PETRA III, DESY).

Published in:

Journal of Applied Crystallography, 2021, v. 54, n. 3, p. 830, doi. 10.1107/S1600576721003034

By:

Wieland, D. C. F.;
Schroer, M. A.;
Gruzinov, A. Yu.;
Blanchet, C. E.;
Jeffries, C. M.;
Svergun, D. I.

Publication type:

Article

Joseph Yariv (1927–2021).

Published in:

Journal of Applied Crystallography, 2021, v. 54, n. 3, p. 1025, doi. 10.1107/S1600576721004453

By:

Helliwell, John R.;
Yariv family

Publication type:

Article

Validation of non‐negative matrix factorization for rapid assessment of large sets of atomic pair distribution function data.

Published in:

Journal of Applied Crystallography, 2021, v. 54, n. 3, p. 768, doi. 10.1107/S160057672100265X

By:

Liu, Chia-Hao;
Wright, Christopher J.;
Gu, Ran;
Bandi, Sasaank;
Wustrow, Allison;
Todd, Paul K.;
O'Nolan, Daniel;
Beauvais, Michelle L.;
Neilson, James R.;
Chupas, Peter J.;
Chapman, Karena W.;
Billinge, Simon J. L.

Publication type:

Article

Analyses of hierarchical structures in vulcanized SBR rubber by using contrast‐variation USANS and SANS.

Published in:

Journal of Applied Crystallography, 2021, v. 54, n. 3, p. 949, doi. 10.1107/S1600576721004222

By:

Takenaka, Mikihito;
Nishitsuji, Shotaro;
Watanabe, Yuki;
Yamaguchi, Daisuke;
Koizumi, Satoshi

Publication type:

Article

Design and use of a sapphire single‐crystal gas‐pressure cell for in situ neutron powder diffraction.

Published in:

Journal of Applied Crystallography, 2021, v. 54, n. 3, p. 839, doi. 10.1107/S1600576721002685

By:

Finger, Raphael;
Kurtzemann, Nadine;
Hansen, Thomas C.;
Kohlmann, Holger

Publication type:

Article

Infrared furnace for in situ neutron single‐crystal diffraction studies in controlled gas atmospheres at high temperatures.

Published in:

Journal of Applied Crystallography, 2021, v. 54, n. 3, p. 822, doi. 10.1107/S1600576721003198

By:

Magro, Fernando;
Ceretti, Monica;
Meven, Martin;
Paulus, Werner

Publication type:

Article

Time‐of‐flight modulated intensity small‐angle neutron scattering measurement of the self‐diffusion constant of water.

Published in:

Journal of Applied Crystallography, 2021, v. 54, n. 3, p. 751, doi. 10.1107/S1600576721002612

By:

Kuhn, Stephen J.;
Geerits, Niels;
Franz, Christian;
Plomp, Jeroen;
Dalgliesh, Robert M.;
Parnell, Steven R.

Publication type:

Article

lamaGOET: an interface for quantum crystallography.

Published in:

Journal of Applied Crystallography, 2021, v. 54, n. 3, p. 987, doi. 10.1107/S1600576721002545

By:

Malaspina, Lorraine A.;
Genoni, Alessandro;
Grabowsky, Simon

Publication type:

Article

The advanced treatment of hydrogen bonding in quantum crystallography.

Published in:

Journal of Applied Crystallography, 2021, v. 54, n. 3, p. 718, doi. 10.1107/S1600576721001126

By:

Malaspina, Lorraine A.;
Genoni, Alessandro;
Jayatilaka, Dylan;
Turner, Michael J.;
Sugimoto, Kunihisa;
Nishibori, Eiji;
Grabowsky, Simon

Publication type:

Article

High‐throughput macromolecular polymorph screening via an NMR and X‐ray powder diffraction synergistic approach: the case of human insulin co‐crystallized with resorcinol derivatives.

Published in:

Journal of Applied Crystallography, 2021, v. 54, n. 3, p. 963, doi. 10.1107/S160057672100426X

By:

Spiliopoulou, Maria;
Valmas, Alexandros;
Triandafillidis, Dimitris-Panagiotis;
Fili, Stavroula;
Christopoulou, Magdalini;
Filopoulou, Aikaterini J.;
Piskopou, Anastasia;
Papadea, Polyxeni;
Fitch, Andrew N.;
Beckers, Detlef;
Degen, Thomas;
Gozzo, Fabia;
Morin, Mickael;
Reinle-Schmitt, Mathilde L.;
Karavassili, Fotini;
Rosmaraki, Eleftheria;
Chasapis, Christos T.;
Margiolaki, Irene

Publication type:

Article