TY - JOUR A1 - Schenk, Jonas A1 - Batzdorf, Lisa A1 - Emmerling, Franziska A1 - Kneipp, Janina A1 - Panne, Ulrich A1 - Buurman, Merwe T1 - Simultaneous UV/Vis spectroscopy and surface enhanced raman scattering of nanoparticle formation and aggregation in levitated droplets N2 - The formation and growth of hydroxylamine reduced silver nanoparticles were investigated by simultaneous Raman and UV/Vis spectroscopy coupled to an acoustic levitator as a sample holder. Based on the UV/Vis spectra, a two step particle formation mechanism with fast initial formation and adjacent coalescence can be proposed for the reduction of silver nitrate with hydroxylamine. The presence of the analyte adenine during particle formation resulted in differences in the adenine SERS signature compared to experiments, where adenine was added after particle synthesis. It was possible to monitor the adenine and sodium chloride induced aggregation of the nanoparticles and its dynamics based on both the extinction spectra and the SERS data. Correlating the information from the extinction spectra with the SERS intensity, the maximum SERS signals were observed at maximum extinction of the aggregated nanoparticle solution at the Raman excitation wavelength. PY - 2012 U6 - https://doi.org/10.1039/c2ay05744a SN - 1759-9660 SN - 1759-9679 N1 - Geburtsname von Batzdorf, Lisa: Tröbs, L. - Birth name of Batzdorf, Lisa: Tröbs, L. N1 - Geburtsname von Buurman, Merwe: Albrecht, M. - Birth name of Buurman, Merwe: Albrecht, M. VL - 4 IS - 5 SP - 1252 EP - 1258 PB - RSC Publ. CY - Cambridge AN - OPUS4-25742 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - CONF A1 - Batzdorf, Lisa A1 - Rump, Doreen A1 - Panne, Ulrich A1 - Emmerling, Franziska T1 - Synthese und Charakterisierung von Cokristallen T2 - 7. Interdisziplinäres Doktorandenseminar CY - Berlin, Germany DA - 2013-02-24 PY - 2013 N1 - Geburtsname von Batzdorf, Lisa: Tröbs, L. - Birth name of Batzdorf, Lisa: Tröbs, L. AN - OPUS4-28286 LA - deu AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - CONF A1 - Batzdorf, Lisa A1 - Rump, Doreen A1 - Emmerling, Franziska A1 - Panne, Ulrich T1 - Strukturelle Charakterisierung von Cokristallen T2 - Anakon 2013 CY - Essen, Germany DA - 2013-03-04 PY - 2013 N1 - Geburtsname von Batzdorf, Lisa: Tröbs, L. - Birth name of Batzdorf, Lisa: Tröbs, L. AN - OPUS4-28287 LA - deu AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - CONF A1 - Batzdorf, Lisa A1 - Wenzel, Klaus-Jürgen A1 - Panne, Ulrich A1 - Emmerling, Franziska T1 - Reorganization of a Zn Oxalate Bipyridine Structure at high Temperatures T2 - Fourth Joint BER II and BESSY II Users Meeting CY - Berlin, Germany DA - 2012-12-12 PY - 2012 N1 - Geburtsname von Batzdorf, Lisa: Tröbs, L. - Birth name of Batzdorf, Lisa: Tröbs, L. AN - OPUS4-27478 LA - deu AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Heiden, Sebastian A1 - Batzdorf, Lisa A1 - Wenzel, Klaus-Jürgen A1 - Emmerling, Franziska T1 - Mechanochemical synthesis and structural characterisation of a theophylline-benzoic acid cocrystal (1:1) N2 - The structure of a mechanochemically synthesised cocrystal containing theophylline (TP) and benzoic acid (BA) has been determined from powder X-ray diffraction data. PY - 2012 U6 - https://doi.org/10.1039/c2ce25236h SN - 1466-8033 N1 - Geburtsname von Batzdorf, Lisa: Tröbs, L. - Birth name of Batzdorf, Lisa: Tröbs, L. VL - 14 IS - 16 SP - 5128 EP - 5129 CY - London, UK AN - OPUS4-26286 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - CONF A1 - Batzdorf, Lisa A1 - Prinz, Carsten A1 - Panne, Ulrich A1 - Emmerling, Franziska T1 - Mechanochemical Synthesis of Co and Zn Oxalate Bipyridine Struktures and Reorganisation at high Temperatures T2 - 3rd International Conference on Metal-Organic Frameworks and Open Framework Compounds CY - Edinburgh, Scotland DA - 2012-09-16 PY - 2012 N1 - Geburtsname von Batzdorf, Lisa: Tröbs, L. - Birth name of Batzdorf, Lisa: Tröbs, L. AN - OPUS4-26921 LA - deu AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - CONF A1 - Batzdorf, Lisa A1 - Panne, Ulrich A1 - Prinz, Carsten A1 - Emmerling, Franziska T1 - Mechanochemical Synthesis of Co and Zn Oxalate Bipyridine Structures and Reorganization at high Temperatures T2 - 3rd International Conference on Metal-Organic Frameworks and Open Framework Compounds CY - Edinburgh, Scotland DA - 2012-09-16 PY - 2012 N1 - Geburtsname von Batzdorf, Lisa: Tröbs, L. - Birth name of Batzdorf, Lisa: Tröbs, L. AN - OPUS4-27192 LA - deu AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - CONF A1 - Batzdorf, Lisa A1 - Panne, Ulrich A1 - Emmerling, Franziska T1 - Mechanochemical Synthesis of Two 2D Organometallic Structures: [Co(C2o4)(4,4'-bipy)] and [Zn3(C2O4)3(4,4'-bipy)4] T2 - 2. Berliner Chemie Symposium vom JCF Berlin CY - Berlin, Germany DA - 2012-04-03 PY - 2012 N1 - Geburtsname von Batzdorf, Lisa: Tröbs, L. - Birth name of Batzdorf, Lisa: Tröbs, L. AN - OPUS4-27193 LA - deu AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - CONF A1 - Batzdorf, Lisa A1 - Emmerling, Franziska A1 - Panne, Ulrich T1 - Mechanochemical Synthesis of Two 2D Organometallic Structures: [Co(C2O4)(4,4'-bipy)] and [Zn3(C2O4)3(4,4'-bipy)4] T2 - 6. Interdisziplinäres Doktorandenseminar CY - Berlin, Germany DA - 2012-02-26 PY - 2012 N1 - Geburtsname von Batzdorf, Lisa: Tröbs, L. - Birth name of Batzdorf, Lisa: Tröbs, L. AN - OPUS4-25495 LA - deu AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - CONF A1 - Batzdorf, Lisa A1 - Nguyen, Thi Yen A1 - Wilke, Manuel A1 - Emmerling, Franziska T1 - Synthese- und Kristallisationsuntersuchungen mittels insitu Synchrotron XRD T2 - Workshop "Zeit und temperaturaufgelöste Röntgenbeugung" CY - Pfinztal, Germany DA - 2013-11-14 PY - 2013 N1 - Geburtsname von Batzdorf, Lisa: Tröbs, L. - Birth name of Batzdorf, Lisa: Tröbs, L. AN - OPUS4-29895 LA - deu AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Wilke, Manuel A1 - Batzdorf, Lisa A1 - Fischer, Franziska A1 - Rademann, Klaus A1 - Emmerling, Franziska T1 - Cadmium phenylphosphonates: preparation, characterisation and in situ investigation N2 - The successful mechanochemical syntheses of three cadmium phenylphosphonates indicates that mechanochemistry is ideally suited for synthesizing metal phosphonates. With this powerful synthesis tool it is possible to synthesize rapidly and efficiently both known and novel phosphonates. The Crystal structures of the two new compounds, and, were solved from PXRD data. They contain monodeprotonated phenylphosphonate and neutral phenylphosphonic acid ligands. The synthesis pathways of all three compounds were investigated in situ. A diffusion mechanism is corroborated by our findings. Intermediates could be detected and identified. The kinetically favored product (3) could always be detected during the syntheses. The thermodynamic stability of the compounds and the stoichiometric ratio of the starting materials are the two directing factors for the synthesis of the final products. KW - Mechanochemistry KW - Metal phosphonate KW - In situ KW - MOF KW - XRD PY - 2016 U6 - http://nbn-resolving.de/urn/resolver.pl?urn:nbn:de:kobv:b43-363322 SN - 2046-2069 VL - 6 IS - 42 SP - 36011 EP - 36019 PB - Royal Soc Chemistry CY - Cambridge, UK AN - OPUS4-36332 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Batzdorf, Lisa A1 - Nguyen, Thi Yen A1 - Rump, Doreen A1 - Emmerling, Franziska T1 - Crystallization behavior of carbamazepine N2 - Carbamazepine (CBZ) is known for its variety of anhydrous and hydrous polymorphs. Herein, a thorough analysis of the crystallization behavior of CBZ is presented. The influence of the solvent and the concentration on the crystallization behavior under different environmental conditions is investigated by combined in situ XRD and Raman spectroscopy measurements. Crystallization studies conducted via conventional crystallization in glass tubes and in levitated droplets using an acoustic levitator indicate a dependence of the crystallization process from solvent and surface. KW - Carbamazepine KW - Polymorphism KW - Acoustic levitation KW - XRD KW - Raman spectroscopy PY - 2014 U6 - https://doi.org/10.1515/zpch-2013-0452 SN - 0942-9352 SN - 2196-7156 SN - 0044-3336 SN - 0044-3328 SN - 0942-9352 N1 - Geburtsname von Batzdorf, Lisa: Tröbs, L. - Birth name of Batzdorf, Lisa: Tröbs, L. VL - 228 IS - 4-5 SP - 493 EP - 501 PB - Oldenbourg CY - München AN - OPUS4-30627 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Batzdorf, Lisa A1 - Zimathies, Annett A1 - Panne, Ulrich A1 - Emmerling, Franziska T1 - Mechanochemical synthesis of [Zn3(C2O4)3(4,4'-bipy)4] and its reorganization at high temperatures N2 - The metal organic layered structure catena-(bis(µ2-4,4'-bipyridine)-tris(µ2-oxalato)-bis(4,4'-bipyridine)-tri-zinc(ii)) ([Zn3(C2O4)3(4,4'-bipy)4]) was synthesized mechanochemically applying three different routes. The synthesis succeeded by i) simultaneously neat grinding the three starting materials zinc acetate dihydrate, oxalic acid dihydrate and 4,4'bipyridine, ii) grinding two compounds and adding the third afterwards, independent of the sequence. The products were characterized using powder X-ray diffraction, Raman spectroscopy, gas adsorption measurements, and scanning electron microscopy. Temperature-dependent synchrotron XRD measurements revealed that the monoclinic structure of [Zn3(C2O4)3(4,4'-bipy)4] rearranges reversibly to a higher ordered orthorhombic structure [Zn(C2O4)(4,4'-bipy)] at high temperatures. KW - Mechanochemistry KW - Metal organic compounds KW - Synchrotron radiation KW - Reorganization PY - 2014 U6 - https://doi.org/10.1515/zpch-2014-0445 SN - 0942-9352 SN - 2196-7156 SN - 0044-3336 SN - 0044-3328 SN - 0942-9352 N1 - Geburtsname von Batzdorf, Lisa: Tröbs, L. - Birth name of Batzdorf, Lisa: Tröbs, L. VL - 228 IS - 4-5 SP - 575 EP - 585 PB - Oldenbourg CY - München AN - OPUS4-30628 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Batzdorf, Lisa A1 - Wilke, Manuel A1 - Szczerba, Wojciech A1 - Reinholz, Uwe A1 - Emmerling, Franziska T1 - Mechanochemical synthesis and characterisation of two new bismuth metal organic frameworks N2 - Two metal organic structures composed of the ligands benzene-1,4-dicarboxylate and pyridine- 2,5-dicarboxylate and bismuth cations are presented: (H2Im)[Bi(1,4-bdc)2] (1) and [Bi(pydc)(NO3)2(H2O)2]*H2O (2) (bdc = benzenedicarboxylate, H2Im = imidazole cation, pydc = pyridinedicarboxylate). Both compounds were synthesised via grinding and the crystal structure of compound (2) was solved based on its powder diffraction pattern. Compound 1 crystallises isostructurally to the dimethyl ammonium containing compound (dma)[(Bi(1,4- bdc)2]. Raman spectroscopy and Extended X-ray absorption fine structure (EXAFS) measurements provided additional information about the two mechanochemically synthesised metal organic compounds. KW - crystal structure KW - mechanochemically synthesis KW - powder diffraction measurements PY - 2014 U6 - http://nbn-resolving.de/urn/resolver.pl?urn:nbn:de:kobv:b43-306296 UR - http://pubs.rsc.org/en/content/articlepdf/2014/ce/c3ce42633e SN - 1466-8033 N1 - Geburtsname von Batzdorf, Lisa: Tröbs, L. - Birth name of Batzdorf, Lisa: Tröbs, L. VL - 16 IS - 25 SP - 5560 EP - 5565 CY - London, UK AN - OPUS4-30629 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Batzdorf, Lisa A1 - Emmerling, Franziska T1 - Mechanochemical synthesis and characterisation of cocrystals and metal-organic compounds N2 - The mechanochemical synthesis of two model compounds, a metal organic framework ([Bi(1,4-bdc)2]*(Im) (bdc = benzene dicarboxylate, Im = imidazole cation)) and a cocrystal (Carbamazepine:Indometacin 1:1) were followed ex situ by combined analytical methods. Powder X-ray diffraction (XRD) and Raman spectroscopy data were evaluated for the synthesis of the metal organic framework. XRD measurements and REM images were analysed for the synthesis of the cocrystal. The measurements revealed that both model compounds were synthesised within minutes. The metal organic framework [Bi(1,4-bdc)2]*(Im) is synthesised via an intermediate structure. The cocrystal Carbamazepine:Indometacin 1:1 is formed within few seconds and afterwards the crystallite size decreases extremely. KW - Powder X-ray diffraction (XRD) KW - Raman spectroscopy KW - mechanochemical synthesis PY - 2014 U6 - http://nbn-resolving.de/urn/resolver.pl?urn:nbn:de:kobv:b43-306305 UR - http://pubs.rsc.org/en/content/articlepdf/2014/fd/c3fd00163f SN - 1359-6640 SN - 1364-5498 N1 - Geburtsname von Batzdorf, Lisa: Tröbs, L. - Birth name of Batzdorf, Lisa: Tröbs, L. SP - 109 EP - 119 PB - RSC CY - Cambridge [u.a.] AN - OPUS4-30630 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - CONF A1 - Batzdorf, Lisa A1 - Fischer, Franziska A1 - Wilke, Manuel A1 - Panne, Ulrich A1 - Emmerling, Franziska T1 - Fast ex situ Analysis of mechanochemical Syntheses and Characterization of Cocrystals and Metal Organic Compounds T2 - 3. Berliner Chemie Symposium des JungChemikerForums Berlin CY - Berlin, Germany DA - 2014-04-09 PY - 2014 N1 - Geburtsname von Batzdorf, Lisa: Tröbs, L. - Birth name of Batzdorf, Lisa: Tröbs, L. AN - OPUS4-30596 LA - deu AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - CONF A1 - Batzdorf, Lisa A1 - Emmerling, Franziska T1 - Mechanochemical synthesis and characterisation of cocrystals and metal organic compounds T2 - 170. Farady Discussion 'Mechanochemistry: From Functional Solids to Single Molecules' CY - Montreal (Canalda) DA - 2014-05-21 PY - 2014 AN - OPUS4-32397 LA - deu AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Batzdorf, Lisa A1 - Fischer, Franziska A1 - Wilke, Manuel A1 - Wenzel, Klaus-Jürgen A1 - Emmerling, Franziska T1 - Direct in situ investigation of milling reactions using combined x-ray diffraction and raman spectroscopy N2 - The combination of two analytical methods including time-resolved in situ X-ray diffraction (XRD) and Raman spectroscopy provides a new opportunity for a detailed analysis of the key mechanisms of milling reactions. To prove the general applicability of our setup, we investigated the mechanochemical synthesis of four archetypical model compounds, ranging from 3D frameworks through layered structures to organic molecular compounds. The reaction mechanism for each model compound could be elucidated. The results clearly show the unique advantage of the combination of XRD and Raman spectroscopy because of the different information content and dynamic range of both individual methods. The specific combination allows to study milling processes comprehensively on the level of the molecular and crystalline structures and thus obtaining reliable data for mechanistic studies. PY - 2015 U6 - https://doi.org/10.1002/anie.201409834 SN - 1433-7851 SN - 1521-3773 SN - 0570-0833 VL - 54 IS - 6 SP - 1799 EP - 1802 PB - Wiley-VCH CY - Weinheim AN - OPUS4-34630 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Fischer, Franziska A1 - Scholz, G. A1 - Batzdorf, Lisa A1 - Wilke, Manuel A1 - Emmerling, Franziska T1 - Synthesis, structure determination, and formation of a theobromine: oxalic acid 2:1 cocrystal N2 - The structure and the formation pathway of a new theobromine : oxalic acid (2 : 1) cocrystal are presented. The cocrystal was synthesised mechanochemically and its structure was solved based on the powder X-ray data. The mechanochemical synthesis of this model compound was studied in situ using synchrotron XRD. Based on the XRD data details of the formation mechanism were obtained. The formation can be described as a self-accelerated ('liquid like') process from a highly activated species. KW - ssNMR spectroscopy KW - Synchrotron measurements KW - API molecule PY - 2015 U6 - http://nbn-resolving.de/urn/resolver.pl?urn:nbn:de:kobv:b43-331567 SN - 1466-8033 VL - 17 IS - 4 SP - 824 EP - 829 CY - London, UK AN - OPUS4-33156 LA - eng AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - CONF A1 - Batzdorf, Lisa A1 - Emmerling, Franziska T1 - Synthesis and Structural Characterization of Cocrystals T2 - International School of Crystallography, 46th Course: The Future of Dynamic Structural Science CY - Erice, Sicily, Italy DA - 2013-05-31 PY - 2013 AN - OPUS4-32502 LA - deu AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - CONF A1 - Zientek, Nicolai A1 - Batzdorf, Lisa A1 - Kraume, M. A1 - Emmerling, Franziska A1 - Maiwald, Michael T1 - Online-NMR-Methoden zur Analyse des Auflösungsverhaltens von pharmazeutischen Cokristallen T2 - 8. Kolloquium Arbeitskreis Prozessanalytik CY - Berlin, Germany DA - 2012-12-03 KW - Quantitative Online-NMR-Spektroskopie KW - Cokristalle KW - Auflösungskinetik PY - 2012 SN - 978-3-9815360-1-0 N1 - Geburtsname von Batzdorf, Lisa: Tröbs, L. - Birth name of Batzdorf, Lisa: Tröbs, L. IS - P12 SP - 40 AN - OPUS4-28267 LA - deu AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - JOUR A1 - Batzdorf, Lisa A1 - Zientek, Nicolai A1 - Rump, Doreen A1 - Fischer, Franziska A1 - Maiwald, Michael A1 - Emmerling, Franziska T1 - Make and break - Facile synthesis of cocrystals and comprehensive dissolution studies N2 - Mechanochemistry is increasingly used as a ‘green alternative’ for synthesizing various materials including pharmaceutical cocrystals. Herein, we present the mechanochemical synthesis of three new cocrystals containing the API carbamazepine (cocrystals CBZ:Indometacin 1:1, CBZ:Benzamide 1:1, and CBZ:Nifedipine 1:1). The mechanochemical reaction was investigated in situ documenting a fast and complete reaction within one minute. Online NMR spectroscopy proved the direct influence of the dissolution behaviour of the coformers to the dissolution behaviour of the API carbamazepine. The dissolution behaviour of the organic cocrystals is compared to the behaviour of the pure drug indicating a general applicability of this approach for detailed cocrystal dissolution studies. KW - Cocrystals KW - Carbamazepine KW - Mechanochemistry KW - Powder diffraction KW - Online NMR spectroscopy PY - 2017 U6 - https://doi.org/10.1016/j.molstruc.2016.11.063 SN - 0022-2860 SN - 1872-8014 VL - 1133 SP - 18 EP - 23 AN - OPUS4-38664 LA - deu AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER - TY - CONF A1 - Batzdorf, Lisa A1 - Zientek, Nicolai A1 - Maiwald, Michael A1 - Emmerling, Franziska T1 - Crystal Structures and Dissolution Behavior of Carbamazepine Cocrystals T2 - Adlershofer Forschungsforum CY - Berlin, Germany DA - 2013-11-12 PY - 2013 N1 - Geburtsname von Batzdorf, Lisa: Tröbs, L. - Birth name of Batzdorf, Lisa: Tröbs, L. AN - OPUS4-29896 LA - deu AD - Bundesanstalt fuer Materialforschung und -pruefung (BAM), Berlin, Germany ER -