Environ. Sci.: Nano, 2020, Advance Article
DOI: 10.1039/D0EN00075B, Paper

Jaroslav Semerád, Jan Filip, Alena Ševců, Miroslav Brumovský, Nhung H. A. Nguyen, Jiří Mikšíček, Tomáš Lederer, Alena Filipová, Jana Boháčková, Tomáš Cajthaml
This work describes an important, environmentally relevant phenomenon of metal nanoparticle aging in relation to the toxicity of nanomaterials; in this case, sulfidated nanoscale zero-valent materials intended for remediation purposes.
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Environ. Sci.: Nano, 2020, Accepted Manuscript
DOI: 10.1039/C9EN01360A, Paper

Open Access

  This article is licensed under a Creative Commons Attribution-NonCommercial 3.0 Unported Licence.

Richard Zepp, Emmanuel Ruggiero, Brad Acrey, Mary J. B. J. B. Davis, Changseok Han, Hsin-Se Hsieh, Klaus Vilsmeier, Wendel Wohlleben, Endalkachew Sahle-Demessie
In recent years, an increasing number of polymeric composites incorporating nanomaterials (NMs) have reached the market. Such nano-enabled products (NEPs) present enhanced performance through improved mechanical, thermal, UV protection, electrical,...
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CrystEngComm, 2020, Advance Article
DOI: 10.1039/D0CE00404A, Communication

Xinrui He, Jian Zhao, Zeqing Tan, Jiaxin Zhao, Xiao Cheng, Chuanjian Zhou
Chalcone single crystals with distinctively different emission color and photoinduced mechanical response are designed and fabricated via fine-tuning the donor substituents.
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CrystEngComm, 2020, 22,2756-2765
DOI: 10.1039/C9CE01885A, Paper

Yaser Balmohammadi, Hamid Reza Khavasi, S. Shahab Naghavi
There is a common perception by the scientific community that a halogen-involving interaction forms when the distance between the donor atom and the acceptor atom is less than the sum of their van der Waals (vdW) radii.
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CrystEngComm, 2020, 22,2718-2727
DOI: 10.1039/D0CE00169D, Paper

Methawee Nukunudompanich, Gekko Budiutama, Kazuma Suzuki, Kei Hasegawa, Manabu Ihara
The surface roughness of the c-TiO₂ layer help controls the perovskite grain size without any other parameter. The direct effect of perovskite grain size on PSC performance is clarified.
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CrystEngComm, 2020, 22,2849-2858
DOI: 10.1039/D0CE00024H, Paper

T. V. M. Sreekanth, P. C. Nagajyothi, K. C. Devarayapalli, J. Shim, K. Yoo
A ZnCo₂O₄ electrocatalyst for the efficient MOR and ORR.
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CrystEngComm, 2020, 22,2788-2794
DOI: 10.1039/C9CE01228A, Paper

Zsolt Dallos, Viktória Kovács Kis, Ferenc Kristály, István Dódony
Bioapatite, the main inorganic component of bone, is similar to hydroxyapatite (HAp, Ca₅[PO₄]₃(OH)) having some [CO₃]²⁻ content which plays an important role in leaching/precipitation processes in many biological lesions.
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CrystEngComm, 2020, 22,2728-2742
DOI: 10.1039/C9CE01972C, Paper

Marc Robin, Stanislas Von Euw, Guillaume Renaudin, Sandrine Gomes, Jean-Marc Krafft, Nadine Nassif, Thierry Azaïs, Guylène Costentin
Monitoring apatite formation through in situ RAMAN and ex situ ssNMR spectroscopy.
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CrystEngComm, 2020, 22,2709-2717
DOI: 10.1039/C9CE01966A, Paper

Xiaojuan Bai, Boxuan Sun, Xuyu Wang, Tianshuo Zhang, Qiang Hao, Bing-Jie Ni, Ruilong Zong, Ziyang Zhang, Xiaoran Zhang, Haiyan Li
The mechanism of the photocatalytic reaction of defective ZnO systems was determined.
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CrystEngComm, 2020, 22,2781-2787
DOI: 10.1039/C9CE02018G, Paper

Hyo Chang Jang, Katsuhiko Saito, Qixin Guo, Kin Man Yu, Wladek Walukiewicz, Tooru Tanaka
We have grown Zn_1−xCd_xO (ZnCdO) thin films by molecular beam epitaxy on α-Al₂O₃ (0001) substrates across the full composition range of 0 ≤ x ≤ 1. A large optical gap of 3.0 eV is obtained in rocksalt-ZnCdO with a low resistivity and high mobility.
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CrystEngComm, 2020, 22,2866-2872
DOI: 10.1039/D0CE00096E, Paper

Andrei V. Churakov, Dmitry A. Grishanov, Alexander G. Medvedev, Alexey A. Mikhaylov, Mikhail V. Vener, Mger A. Navasardyan, Tatiana A. Tripol'skaya, Ovadia Lev, Petr V. Prikhodchenko
2-Aminobenzimidazole peroxosolvate – the third H₂O₂ crystalline adduct stabilized with the maximum possible number of hydrogen bonds formed by one hydrogen peroxide molecule.
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CrystEngComm, 2020, 22,2795-2805
DOI: 10.1039/D0CE00170H, Paper

Lingli Zheng, Yingqiang Zhao, Yongshan Xu, Chen Yang, Jun Zhang, Xianghong Liu
CoSnO₃ nanoboxes exhibit a p-type response to detect triethylamine at 100 °C with a limit of detection of 134 ppb.
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CrystEngComm, 2020, 22,2837-2844
DOI: 10.1039/D0CE00238K, Paper

Xinfang Liu, Liyong Du, Rongfang Li, Ningning Ma, Mengdi You, Xun Feng
Isostructural Ln-CPs (1-Eu and 2-Tb) show almost the same high detection ability for Fe³⁺ and different detection abilities for aniline. The detection difference was studied through PXRD, UV-vis, luminescence lifetimes and Hirshfeld surface analysis.
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CrystEngComm, 2020, 22,2743-2755
DOI: 10.1039/D0CE00064G, Paper

Bowen Sun, Hui Wang, Jiakun Wu, Yanling Geng, Jixiang Xu, Yaowei Wang, Yanyan Li, Haifeng Lin, Lei Wang
Unique ZnS@CdS@Cd_0.5Zn_0.5S-MoS₂ hollow nanospheres with abundant active sites and enhanced light-harvesting and charge separation demonstrate efficient H₂ evolution from visible-light-driven water-splitting.
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CrystEngComm, 2020, 22,2827-2836
DOI: 10.1039/D0CE00171F, Paper

Binghui Xu, Xin Dai, Qingke Tan, Yuan Wei, Gonggang Liu, Guanglei Wu
In this work, a nano-sized goethite and zinc oxide hetero-structure (FeOOH@ZnO) dispersed on reduced graphene oxide (RGO) sheets was synthesized for the first time to construct a ternary composite (FeOOH@ZnO/RGO) via a stepped graphene oxide (GO) deoxygenation process.
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CrystEngComm, 2020, 22,2806-2816
DOI: 10.1039/D0CE00235F, Paper

Xiaoyun Hao, Jingwen Shi, Yong Dou, Tong Cao, Zhen Zhou, Lu Yang, Dacheng Li, Qingyun Liu, Jianzhuang Jiang, Daopeng Zhang
Six new cyanide-bridged complexes (0–3D) have been assembled by employing one copper compound and six cyano precursors. Investigation of the magnetic properties revealed the ferro- or antiferromagnetic coupling between Fe^III/Cr^I ion and Cu^II ion.
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CrystEngComm, 2020, 22,2817-2826
DOI: 10.1039/D0CE00070A, Paper

Florbela Pereira
Machine learning algorithms were explored for the prediction of the crystallization propensity based on molecular descriptors and fingerprints generated from 2D chemical structures and 3D chemical structures optimized with empirical methods.
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CrystEngComm, 2020, 22,2766-2771
DOI: 10.1039/D0CE00014K, Paper

Ornella E. Y. Kilinkissa, Krishna K. Govender, Nikoletta B. Báthori
Comparison of chiral and racemic binary cocrystals showed that the chiral building block limits the formation of certain intermolecular interactions, decreases the packing efficiency, lowers the melting point and increases aqueous solubility.
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CrystEngComm, 2020, 22,2845-2848
DOI: 10.1039/D0CE00263A, Paper

Open Access

  This article is licensed under a Creative Commons Attribution-NonCommercial 3.0 Unported Licence.

Teng Li, Frank Krumeich, Jeroen A. van Bokhoven
Exploiting the protective role of extra-framework aluminum species on the crystal rim, all-silica hollow zeolites are efficiently produced by demetallation.
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CrystEngComm, 2020, Advance Article
DOI: 10.1039/D0CE00113A, Paper

Mohd Nazri Abd Rahman, Yusnizam Yusuf, Afiq Anuar, Mohamad Raqif Mahat, Narong Chanlek, Noor Azrina Talik, Muhammad I. M. Abdul Khudus, Norzaini Zainal, Wan Haliza Abd Majid, Ahmad Shuhaimi
An atomically flat covering with a dense and crack-free surface of aluminium nitride films was successfully deposited on a sapphire-(0 0 0 1) substrate through a pulsed atomic-layer epitaxy technique via horizontal metalorganic chemical vapour deposition.
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CrystEngComm, 2020, Advance Article
DOI: 10.1039/D0CE00370K, Paper

Corrado Di Nicola, Alessia Tombesi, Marco Moroni, Rebecca Vismara, Fabio Marchetti, Riccardo Pettinari, Luca Nardo, Guglielmo Vesco, Simona Galli, Silvia Casassa, Luciano Pandolfo, Claudio Pettinari
Enlarging the family of CPs with the {Cu(μ-pz)₂} building unit: synthesis, thermal behaviour, crystal structure and spectroscopic properties of [Cu(μ-4-Xpz)₂(μ-DMF)]_n (4-Xpz = 4-Xpyrazolate, X = H, Cl, Br, I) and the non-solvated counterparts.
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CrystEngComm, 2020, Advance Article
DOI: 10.1039/D0CE00416B, Communication

Takumi Kusakawa, Takayuki Goto, Akiko Hori
Expanded π-conjugated coordination complexes, [M(L²)₂] (M = Cu²⁺, Pd²⁺, Pt²⁺; L² = dinaphthoylmethanido⁻), were prepared and their unique electron contributions and electrophile/nucleophile characteristics were found due to the supramolecular associations.
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CrystEngComm, 2020, Accepted Manuscript
DOI: 10.1039/D0CE00317D, Paper

Zhen-Li Yang, Jian Qin, Jun- Qing Yang , Jianguo Zhang
Research on novel energetic coordination polymers (ECPs) is becoming increasingly important for energetic materials, numerous ECPs were reported and found to be potential energetic materials. In this study, 4,5-dicarboxylic-1,2,3-triazolean was...
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CrystEngComm, 2020, Accepted Manuscript
DOI: 10.1039/D0CE00269K, Paper

Selma Piranej, Michael A. W. Shelhart Sayers, Gregory J. Deye, Sergey N. Maximoff, Jonathan P. Hopwood, Haejun Park, Jean G. Slavsky, Jacob Ciszek
Reactivity trends for molecular solids cannot be explained exclusively through topochemical phenomenon (i.e. diffusivity, reaction cavities) or electronic structure of the molecules. As an example of this class, Diels-Alder reactions...
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CrystEngComm, 2020, Advance Article
DOI: 10.1039/D0CE00294A, Paper

Chih-Tung Yang, Xiang-Kai Yang, Ji-Hong Hu, Wei-Te Lee, Tsun-Ren Chen, Chih-Chieh Wang, Jhy-Der Chen
Two extended metal chains based on linear tetracopper units are reported, in which the bromide complex undergoes reversible structural transformation and luminescence change.
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CrystEngComm, 2020, Accepted Manuscript
DOI: 10.1039/D0CE00489H, Highlight

Zhonghua Pan, chenglong deng, zhi wang , Jin-Qing Lin, Geng-Geng Luo, Di Sun
Silver clusters with atomic precision have garnered immense attention owing to their aesthetic structures and fascinating properties. Assembly of silver clusters involves organizing positively charged silver ions into an intricate...
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CrystEngComm, 2020, Accepted Manuscript
DOI: 10.1039/D0CE00430H, Paper

Hai-Huan Yu, Jia-Qi Chi, Zhong-Min Su, Xiao Li, Jing Sun, Chen Zhou, Xiao-Li Hu, Qun Liu
The existence of Cr2O72- anions, excessive Fe3+ cations in water and picric acid in seawater have irreversible harm to human health and aquatic organism. Herein, a water-stable terbium metal-organic framework...
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CrystEngComm, 2020, Accepted Manuscript
DOI: 10.1039/D0CE00347F, Paper

Yu Feng, Erwei Du, Shijing Gong, Ke Yu, Xiaofan Chen, Ziqiang Zhu
The MoS2@VS2 micro-nano composite was synthesized via a two-step hydrothermal method. The field emission properties of MoS2@VS2 micro-nano composite were investigated for the first time. The finger-like VS2 has a...
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CrystEngComm, 2020, Accepted Manuscript
DOI: 10.1039/D0CE00360C, Paper

Xiufang Li, Qunmei Fan, Qiang Zhang, Shuqin Yan, Renchuan You
Thermal annealing strongly impacts the crystallization of proteins. Despite the fundamental importance for the crystallization of silk fibroin, the underlying crystallization kinetics of silk fibroin in freezing state has not...
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CrystEngComm, 2020, Advance Article
DOI: 10.1039/D0CE00168F, Paper

Shubhangi Kakkar, K. Renuka Devi, Michael Svärd, Åke Rasmuson
Nucleation behaviour of salicylamide in different solvents was determined and compared with salicylic acid, attempting to progress the rationalization of the influence of the solvent and solute on crystal nucleation of organic compounds in solution.
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CrystEngComm, 2020, Advance Article
DOI: 10.1039/D0CE90057E, Correction

Open Access

  This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.

Chenglan Zhao, Yuqian Jiang, Shunfei Liang, Fang Gao, Li Xie, Lingyun Chen
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CrystEngComm, 2020, Advance Article
DOI: 10.1039/D0CE00026D, Paper

Open Access

  This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.

Thai T. H. Nguyen, Robert B. Hammond, Ioanna D. Styliari, Darragh Murnane, Kevin J. Roberts
A detailed inter-molecular (synthonic) analysis of terbutaline sulfate, an ionic addition salt for inhalation drug formulation, is related to its crystal morphology, the surface chemistry of the habit faces and hence to its crystal surface energy.
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CrystEngComm, 2020, Advance Article
DOI: 10.1039/C9CE01884K, Communication

Shuangliang Cheng, Rachel E. Hunneke, Mengkun Tian, Eric Lukosi, Mariya Zhuravleva, Charles L. Melcher, Yuntao Wu
We developed novel LiCl–CeCl₃ eutectic scintillators that are capable of detecting thermal neutrons.
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CrystEngComm, 2020, Accepted Manuscript
DOI: 10.1039/D0CE00386G, Paper

Jinxin Huang, Zongqi Wang, Bing Teng, Hong Liu, Xixi Zheng, Shaohua Ji
A series of K(D_xH_1-x)₂PO₄ (DKDP) crystals with different saturating temperature and deuteration levels were grown by point-seed rapid growth method. The correlation between deuterium segregation coefficient and temperature and deuterium...
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CrystEngComm, 2020, Advance Article
DOI: 10.1039/D0CE00311E, Paper

Lei Gao, Yunhui Hao, Xiunan Zhang, Xin Huang, Ting Wang, Hongxun Hao
Photomechanical motions of the polymorphs of trans-4,4'-azopyridine are distinct under the influence of different molecular packing and intermolecular interactions.
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CrystEngComm, 2020, Advance Article
DOI: 10.1039/D0CE00214C, Paper

João P. P. Copetti, Paulo R. S. Salbego, Tainára Orlando, Jéssica M. L. Rosa, Gabriela F. Fiss, João P. G. de Oliveira, Mário L. A. A. Vasconcellos, Nilo Zanatta, Helio G. Bonacorso, Marcos A. P. Martins
The crystallization mechanisms of a series of fourteen 7-chloro-4-substituted-quinolines were proposed based on a retrocrystallization approach using the supramolecular cluster as demarcation.
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CrystEngComm, 2020, Accepted Manuscript
DOI: 10.1039/D0CE00644K, Communication

Kazuyuki Maeda, Kentaro Wakui, Kyosuke Arakawa, Atsushi Kondo
Topotactic pillaring of lamellar aluminophosphate (ALPO) layers with zinc cations is used to prepare microporous zincoaluminophosphate (ZnAPO) with AFY-type framework for the first time. This approach should be promising for...
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CrystEngComm, 2020, Accepted Manuscript
DOI: 10.1039/D0CE00417K, Paper

Weidong Hou, Jia Yang, Haiming Xu, Dongya Li, Zhongwei Zou, Dongsheng Xia
Nymphaea-like BiOCl with oxygen vacancies (OVs) was successfully prepared by adjusting the pH of the precursor and using aspartic acid as surfactant. The as-fabricated samples were investigated by XRD, SEM,...
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CrystEngComm, 2020, 22,2970-2977
DOI: 10.1039/D0CE00251H, Paper

Prasanata Kumar Bhaumik, Abhisek Banerjee, Tamal Dutta, Sudipta Chatterjee, Antonio Frontera, Shouvik Chattopadhyay
The ethoxy groups have a dual effect in hindering the attack of the pseudo-halides on the nickel(II) centre and also in stabilizing the complex by intra-molecular interactions.
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CrystEngComm, 2020, 22,3059-3069
DOI: 10.1039/D0CE00310G, Paper

Smriti Thakur, Sanjay K. Mandal
Morphology transformation and dimensionality change as a result of dilution and post-synthetic annealing are reported.
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CrystEngComm, 2020, 22,2978-2989
DOI: 10.1039/D0CE00106F, Paper

Utsav Garg, Yasser Azim, Aranya Kar, Chullikkattil P. Pradeep
Revisit of acid–aminopyrimidine synthons to explore the robustness in presence of linear hetrotetramer and heterotrimer synthon.
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CrystEngComm, 2020, 22,2914-2918
DOI: 10.1039/D0CE00244E, Paper

Shengliang Zhong, Honghong Zou, Yanhua Ji, Chenghui Zeng, Lei Wang, Yanhong Chen, Hualan Xu
Coordination polymer superstructures connected by a flange union with a good geometry were fabricated. Assembly, disassembly and reassembly process happened during the formation.
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CrystEngComm, 2020, 22,2945-2952
DOI: 10.1039/D0CE00185F, Paper

Jiacheng Yao, Min Zhang, Hongfei Yin, Muhammad Arif, Xiaoheng Liu
Fabrication of rose-like WO₃ by chemical bath method.
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CrystEngComm, 2020, 22,2990-2997
DOI: 10.1039/D0CE00112K, Paper

Yan-Kai Li, Yu-Ge Wang, Cui-Liu Fu, You-Liang Zhu, Zhan-Wei Li, Zhao-Yan Sun
The crystallization transformation from form II to form I in PB-1/CNT materials is mainly influenced by the lamellar thickness.
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CrystEngComm, 2020, 22,3033-3041
DOI: 10.1039/D0CE00224K, Paper

Chunyan Dong, Yan Zhou, Na Ta, Wenjie Shen
Ceria nanocubes of 10–20 nm were hydrothermally synthesized, involving Ce(OH)₃ rods and small-sized CeO₂ polyhedra/cubes as building blocks.
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CrystEngComm, 2020, 22,2926-2932
DOI: 10.1039/D0CE00086H, Paper

Hualan Xu, Ran Liu, Yongmei Zhu, Jinjiang Li, Changfeng Wan, Hang Zhang, Chuying Ouyang, Shengliang Zhong
Scandium-based coordination polymer octahedrons with concaved surfaces have been fabricated. The formation mechanism was also investigated. Sc₂O₃ octahedrons were obtained after simple calcination in a N₂ atmosphere.
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CrystEngComm, 2020, 22,3070-3078
DOI: 10.1039/D0CE00075B, Paper

Yucheng Hao, Yang Pan, Yuan Lin, Linbo He, Guangjie Ge, Yu Ruan, Haida Zhou, Yang Xue, Kisan Koirala
Three novel highly porous aluminophosphates were synthesized through mild hydrothermal methods. Interestingly, among them, α-NaAlPO₄(OH) is polar and exhibits moderate nonlinear optical properties with a short cutoff edge.
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CrystEngComm, 2020, 22,2953-2963
DOI: 10.1039/D0CE00268B, Paper

Chenglan Zhao, Yuqian Jiang, Shunfei Liang, Fang Gao, Li Xie, Lingyun Chen
2D porous nickel oxalate thin sheets constructed by ultrathin nanosheets were first synthesized by using a simple hydrothermal method. The resulting porous thin sheets exhibited superior supercapacitor performance.
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CrystEngComm, 2020, 22,2884-2888
DOI: 10.1039/D0CE00305K, Communication

Mei-li Qi, Shengkun Yao, Xiao-Cun Liu, Xiaoning Wang, Fengkun Cui
Well-defined carbonated hydroxyapatite microspheres assembled from nanosheets were synthesized by a Na₂EDTA-assisted hydrothermal homogeneous precipitation route.
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CrystEngComm, 2020, 22,2933-2944
DOI: 10.1039/D0CE00275E, Paper

Anna Goldman, Beatriz Gil-Hernández, Simon Millan, Serkan Gökpinar, Christian Heering, Ishtvan Boldog, Christoph Janiak
The prototypal [M₂(EtBCP)₂(DABCO)_0.5] MOFs, compliant with isoreticular expansion in two-dimensions, show flexibility manifested by a two-step CO₂ adsorption isotherm, which might be associated to the “lever-action” of the metal-phosphonate moieties.
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