organic

Machine learning methods to predict the crystallization propensity of small organic molecules

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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organic

A water-stable terbium metal-organic framework with functionalized ligands for the detection of Fe3+, Cr2O72- ions in water and picric acid in seawater

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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organic

Intrinsically porous molecular building blocks for metal organic frameworks tailored by the bridging effect of counter cations

CrystEngComm, 2020, 22,2889-2894
DOI: 10.1039/D0CE00397B, Communication
Open Access
Peng Yang, Buthainah Alshankiti, Niveen M. Khashab
Intrinsically porous molecular building blocks are used for the rational design and construction of molecular-level controlled porous materials.
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organic

Mining the Cambridge Database for theoretical chemistry. Mi-LJC: a new set of Lennard-Jones–Coulomb atom–atom potentials for the computer simulation of organic condensed matter

CrystEngComm, 2020, Advance Article
DOI: 10.1039/D0CE00334D, Paper
Angelo Gavezzotti, Leonardo Lo Presti, Silvia Rizzato
A novel, universal Lennard-Jones–Coulomb (LJC) atom–atom force field parametrization reproduces the experimental sublimation enthalpies of 377 molecular crystals drawn from the CSD.
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organic

Open metal site (OMS) and Lewis basic site (LBS)-functionalized copper–organic framework with high CO2 uptake performance and highly selective CO2/N2 and CO2/CH4 separation

CrystEngComm, 2020, Advance Article
DOI: 10.1039/C9CE02005E, Paper
Cheng He, Chao Hou, Yu Min Wang, Xue Yong Gong, Hong Li Jiang, Yong Bin Sun, Kun Liu, Xiao Qun Cao
A robust porous metal–organic framework with dual functionalities of open metal sites (OMSs) and O-rich Lewis basic sites (LBSs) has been designed and synthesized, and shows high CO2 uptake and excellent selectivity for CO2 over N2 and CH4.
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organic

Chirality and Stereoisomerism of Organic Multicomponent Crystals in the CSD

CrystEngComm, 2020, Accepted Manuscript
DOI: 10.1039/D0CE00403K, Paper
Open Access
Eline Grothe, hugo meekes, Rene de Gelder
With the current interest in multicomponent crystals containing chiral residues, a wide variety of studies could benefit from a comprehensive inventory of chirality in multicomponent crystals. We combined computational approaches...
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organic

Pseudosymmetric layers in high-Z' and P1 structures of organic molecules

CrystEngComm, 2020, Advance Article
DOI: 10.1039/D0CE00302F, Paper
Carolyn Pratt Brock
Layers having obvious approximate symmetry higher than that of the overall 3-D crystal are present in 20–25% of the Z' > 4 and P1 organic structures archived in the Cambridge Structural Database. In some structures different types of layers alternate.
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organic

Two Co-based MOFs assembled from an amine-functionalized pyridinecarboxylate ligand: inorganic acid-directed structural variety and gas adsorption properties

CrystEngComm, 2020, Advance Article
DOI: 10.1039/D0CE00475H, Paper
Zhenzhen Jiang, Ping Zhou, Tingting Xu, Lihui Fan, Simin Hu, Jingxian Chen, Yabing He
A pair of Co-based MOFs exhibited inorganic acid-driven structural diversities, and one of them displayed the C2H2 separation and purification potential.
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organic

Organic vegetable project for expatriates

Kanjikuzhy panchayat to distribute 10 lakh vegetable saplings on May 20




organic

Organic molecular solids: properties and applications / edited by William Jones

Online Resource




organic

Quantum chemistry of nanotubes: electronic cylindrical waves / Pavel N. D'yachkov (Quantum Chemistry Laboratory, Kurnakov Institute of General and Inorganic Chemistry, Russian Academy of Sciences, Moscow, Russia)

Online Resource




organic

Himachal''s organic crop zone

Tucked away from Himachal''s prosperous vegetable and fruit belt, Pangi is yet to grab the spotlight it deserves for growing organic fruits and vegetables in abundance.




organic

After organic farming, it''s agro-tourism for this bureaucrat

For the past year and a half, Assistant Excise and Taxation Commissioner Y S Matta is doing organic farming on his 30 acres of land in Kalomajra village....




organic

Punjab goes green, reaps profits from organic wheat

While a majority of wheat farmers in Punjab and Haryana are ruing the loss of yield, all those who went for organic and natural farming this time are a happy lot.




organic

A Kerala village set for organic makeover

Farmers of Mankulam village panchayat in Kerala''s Idukki district are nursing their soil to reverse the damage done to it over the years.




organic

Sowing the seeds of organic farming

When he would come home from his modest half-acre farm after sundown, Ramesh Pradhan wouldn''t go near his children and wife until he had bathed and changed his clothes.




organic

The Organic Shift

Cautiously, but convincingly, farmers of Katewadi in Baramati district have embraced organic farming, bidding farewell to pesticides and chemical fertilisers for the sake of their own health and that of their crops.




organic

Organic lessons from a lab

After isolating two exotic species of farmer-friendly insect bio-agents, Assam''s State Bio-Control Laboratory is sharing them with farmers to control pests....




organic

Kashmir''s organic farms: 32,000 hectares and growing

SKUAST experts teach basics of organic farming to more than 200 farmers, encourage them to take it up on a larger scale




organic

Jammu to switch to organic farming, with 800 hectares

To explore markets elsewhere in the country and abroad for its saffron, basmati rice and rajmash among various other agricultural produce, the Jammu-Kashmir government is adopting organic farming in a systematic manner




organic

'Organic farming can create 60 lakh jobs'

State accounts for nearly 40% of total area under certified organic farming in India.




organic

Assam''s new farm mantra: go organic

30 bighas to be identified in each of the 126 Assembly constituencies; Rs 20 cr earmarked




organic

Going organic

In Punjab''s Roopnagar district, farmers with small landholdings are shunning costly chemical fertilisers and pesticides to grow wheat, paddy, maize and vegetables, using organic methods




organic

Organic dairy farming picks up in villages

US-returned businessman sets up modern dairy farm, shares equipment and know-how with locals




organic

It''s the organic branding that counts

MP farmers rarely use chemicals but few manage the organic farming certificate to market their produce better




organic

Going Organic

A group of farmers have come up with their own brand and are selling products from a mandi board shop in Moga.




organic

Solution synthesis of inorganic films and nanostructured materials: symposium held April 9-13, 2012, San Francisco, California, U.S.A. / editors, Menka Jain ... [et al.]

Hayden Library - TA418.9.N35 S967 2012




organic

Solution synthesis of inorganic functional materials -- films, nanoparticles and nanocomposites: symposium held April 1-5, 2013, San Francisco, California, U.S.A. / editors, Menka Jain, Quanxi Jia, Teresa Puig, Hiromitsu Kozuba

Hayden Library - TA418.9.N35 S656 2013




organic

Targeting STAT3 anti-apoptosis pathways with organic and hybrid organic–inorganic inhibitors

Org. Biomol. Chem., 2020, 18,3288-3296
DOI: 10.1039/C9OB02682G, Paper
Matthew B. Minus, Haopei Wang, Jaime O. Munoz, Alexandra M. Stevens, Alicia E. Mangubat-Medina, Michael J. Krueger, Wei Liu, Moses M. Kasembeli, Julian C. Cooper, Mikhail I. Kolosov, David J. Tweardy, Michele S. Redell, Zachary T. Ball
Recurrence and drug resistance are major challenges in the treatment of acute myeloid leukemia (AML) that spur efforts to identify new clinical targets and active agents.
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organic

Composites with inorganic matrix for repair of concrete and masonry structures: held at the ACI Spring 2017 Convention, Detroit, Michigan, USA, 26-30 March 2017 / editors, Gianmarco de Felice, Lesley H. Sneed, Antonio Nanni

Barker Library - TA439.A57 2017




organic

Experimenting at the boundaries of life: organic vitality in Germany around 1800 / Joan Steigerwald

Hayden Library - QH305.2.G3 S74 2019




organic

Next Tech - Are Organic TVs the Way of the Future?

LED screens were once the way of the future, and now OLEDs are ushering in a new wave of television viewing. Featuring organic molecules that illuminate in response to electric currents, OLEDs allow for a thin screen that produces deeper, more detailed images.




organic

Viscosity of pure organic liquids and binary liquid mixtures / Christian Wohlfarth, author ; M.D. Lechner, editor

Wohlfarth, C., author




organic

Optimizing NMR methods for structure elucidation : characterizing natural products and other organic compounds / by Darcy C. Burns (University of Toronto, Canada, email, darcy.burns@utoronto.ca) and William F. Reynolds (University of Toronto, Canada, emai

Burns, Darcy C., author




organic

Introduction to analytical methods in organic geochemistry Jan Schwarzbauer, Branimir Jovančićević

Online Resource




organic

Ultrafast assembly of swordlike Cu3(1,3,5-benzenetricarboxylate)n metal–organic framework crystals with exposed active metal sites

Nanoscale Horiz., 2020, Advance Article
DOI: 10.1039/D0NH00171F, Communication
Heba Ahmed, Xinci Yang, Yemima Ehrnst, Ninweh N. Jeorje, Susan Marqus, Peter C. Sherrell, Ahmed El Ghazaly, Johanna Rosen, Amgad R. Rezk, Leslie Y. Yeo
A new acoustomicrofluidic method for synthesizing copper-based metal–organic frameworks is shown to yield novel large aspect ratio elongated crystal morphologies with high active metal site density on their surfaces, leading to enhanced conductivity.
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organic

Fast Deposition of Ultrathin, Highly Crystalline Organic Semiconductor Film for High-Performance Transistors

Nanoscale Horiz., 2020, Accepted Manuscript
DOI: 10.1039/D0NH00096E, Communication
Xiali Zhang, Wei Deng, Bei Lu, Xiaochen Fang, Xiujuan Zhang, Jiansheng Jie
Ultrathin organic semiconductor (OSC) crystalline films hold the promise of achieving high-performance, flexible, and transparent organic electronic devices. However, fast and high-throughput solution deposition of uniform pinhole-free ultrathin OSC crystalline...
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organic

Near-infrared electron acceptors with fused nonacyclic molecular backbones for nonfullerene organic solar cells

Mater. Chem. Front., 2020, Advance Article
DOI: 10.1039/C9QM00754G, Research Article
Jianquan Zhang, Yunke Li, Zhengxing Peng, Fujin Bai, Lik-Kuen Ma, Harald Ade, Zhengke Li, He Yan
Two strong electron-donating moieties were fused into the molecular backbone of small molecular acceptors showing dramatically extended absorption beyond 900 nm.
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organic

Electrical stability study of polymer-based organic transistors in ambient air using an active semiconducting/insulating polyblend-based pseudo-bilayer

Mater. Chem. Front., 2020, Advance Article
DOI: 10.1039/D0QM00048E, Research Article
Bo-Ren Lin, Horng-Long Cheng, Hung-Han Lin, Fu-Chiao Wu, Jia-Hui Lin, Wei-Yang Chou, Jrjeng Ruan, Yu-Wu Wang
Polymeric transistors with unexpected nondecaying features even in ambient air are fabricated based on a P3HT/PMMA pseudo-bilayer with microphase separation morphology.
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organic

Aromatic imide/amide-based organic small-molecule emitters for organic light-emitting diodes

Mater. Chem. Front., 2020, Advance Article
DOI: 10.1039/D0QM00084A, Review Article
Yuanyuan Qin, Guoping Li, Ting Qi, Hui Huang
Aromatic imide/amide-based organic small molecules as emitters in organic light-emitting diodes have caught increasing attention. This study summarized their advances in terms of device performance and molecular design rules over the past 20 years.
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organic

Novel cathode buffer layer of Al(acac)3 enables efficient, large area and stable semi-transparent organic solar cells

Mater. Chem. Front., 2020, Accepted Manuscript
DOI: 10.1039/D0QM00198H, Research Article
Yiming Bai, Chunyan Zhao, Rongkang Shi, Jun Wang, Fuzhi Wang, Tasawar Hayat, Ahmed Alsaedi, Zhan'ao Tan
Electrode buffer layer plays a more crucial in semi-transparent organic solar cells (ST-OSCs) than that of the opaque devices due to the additional requirements of the average visible transmittance (AVT)...
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organic

Boosting the piezocatalytic performance towards degradation of organic pollutant of Bi2WO6 nanosheets

Mater. Chem. Front., 2020, Accepted Manuscript
DOI: 10.1039/D0QM00179A, Research Article
Aize Hao, Xueer Ning, Yali Cao, Jing Xie, Dianzen Jia
The novel piezocatalyst of Bi2WO6 nanosheets (BWO NS) are successfully synthesized by a simple, green and harmless solid-state chemistry method. The BWO NS present excellent piezocatalytic activity in contrast with...
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organic

Sandwich structured dielectrics for air-stable and flexible low-voltage organic transistors in ultrasensitive pressure sensing

Mater. Chem. Front., 2020, 4,1459-1470
DOI: 10.1039/D0QM00062K, Research Article
Yue Jiang, Ziyang Liu, Zhigang Yin, Qingdong Zheng
A novel type of polymer sandwich dielectric is developed for air-stable, hysteresis-free and flexible OTFTs which can be used for low-power pressure sensors with ultrahigh sensitivity, wide detection range and fast response.
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organic

The role of dipole moment in two fused-ring electron acceptor and one polymer donor based ternary organic solar cells

Mater. Chem. Front., 2020, 4,1507-1518
DOI: 10.1039/D0QM00016G, Research Article
Xunfan Liao, Yongjie Cui, Xueliang Shi, Zhaoyang Yao, Heng Zhao, Yongkang An, Peipei Zhu, Yaxiao Guo, Xiang Fei, Lijian Zuo, Ke Gao, Francis Lin, Qian Xie, Lie Chen, Wei Ma, Yiwang Chen, Alex K.-Y. Jen
The dipole moment of FREAs’ terminals has been unveiled as an important factor and its working mechanism has been thoroughly investigated. Our results demonstrate that the dipole moment should also be taken into account in designing ternary OSCs.
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organic

Opportunities and critical factors of porous metal-organic frameworks for the industrial separation of light olefins

Mater. Chem. Front., 2020, Accepted Manuscript
DOI: 10.1039/D0QM00186D, Review Article
Tianhao Lan, Libo Li, Yang Chen, Xiaoqing Wang, Jiangfeng Yang, Jinping Li
Light olefins (ethylene, propylene, and 1,3-butadiene) are widely used as building blocks in the petrochemical industry and for the fabrication of everyday products. Developing energy cost-efficient porous materials for the...
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organic

[ASAP] Balancing Density Functional Theory Interaction Energies in Charged Dimers Precursors to Organic Semiconductors

Journal of Chemical Theory and Computation
DOI: 10.1021/acs.jctc.9b01193




organic

[ASAP] Electronic Structure of Multicomponent Organic Molecular Materials: Evaluation of Range-Separated Hybrid Functionals

Journal of Chemical Theory and Computation
DOI: 10.1021/acs.jctc.0c00138




organic

The matrix effect in TOF-SIMS analysis of two-element inorganic thin films

J. Anal. At. Spectrom., 2020, Advance Article
DOI: 10.1039/C9JA00428A, Paper
Agnieszka Priebe, Tianle Xie, Gerhard Bürki, Laszlo Pethö, Johann Michler
Investigation of the matrix effect in Zr-based two-element alloys under continuous bombardment of a Ga+ primary ion beam in a study of ionization probability towards exploring the potential and limitations of gas-assisted TOF-SIMS.
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organic

Screening metal-free photocatalysts from isomorphic covalent organic frameworks for the C-3 functionalization of indoles

J. Mater. Chem. A, 2020, 8,8706-8715
DOI: 10.1039/D0TA02164D, Paper
Ziping Li, Songjie Han, Chunzhi Li, Pengpeng Shao, Hong Xia, He Li, Xiong Chen, Xiao Feng, Xiaoming Liu
An excellent framework photocatalyst was screened from a series of isomorphic COFs. The photocatalytic properties of C-3 functionalization of indoles by COF-based photocatalysts were first reported.
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organic

Anderson polyoxometalate built-in covalent organic frameworks for enhancing catalytic performances

J. Mater. Chem. A, 2020, 8,8548-8553
DOI: 10.1039/D0TA02443K, Paper
Rui Ma, Naifang Liu, Ting-Ting Lin, Tianbo Zhao, Sheng-Li Huang, Guo-Yu Yang
Anderson polyoxometalate-based covalent organic frameworks exhibited the highest catalytic activity in the photodegradation of RhB and MB, as well as 100% selective oxidation of sulfides to sulfoxides.
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