A discussion of the mechanism of nylon 6, 6 dissolving process using CaCl_2/MeOH as the sol-vent is presented. The calcium chloride forms a complex compound with nylon 6, 6 by breakingthe hydrogen bonds. The melting p...A discussion of the mechanism of nylon 6, 6 dissolving process using CaCl_2/MeOH as the sol-vent is presented. The calcium chloride forms a complex compound with nylon 6, 6 by breakingthe hydrogen bonds. The melting point of the CaCl_2 --nylon 6, 6 complex was found to be reducedby 91K relative to the pure nylon 6, 6 polymer. The role of methanol is somewhat similar to acatalyst. The results demonstrate that the complexation of a Lewis acid (CaCl_2) and a Lewis base(nylon 6, 6) can be used to probe intermolecular interactions such as hydrogen bonding in polymers, to modify the polymer properties and mediate its solubility and processing.展开更多
Dissolved organic matter(DOM) is ubiquitous in the environment and has high reactivity.Once engineered nanoparticles(ENPs) are released into natural systems, interactions of DOM with ENPs may significantly affect ...Dissolved organic matter(DOM) is ubiquitous in the environment and has high reactivity.Once engineered nanoparticles(ENPs) are released into natural systems, interactions of DOM with ENPs may significantly affect the fate and transport of ENPs, as well as the bioavailability and toxicity of ENPs to organisms. However, because of the complexity of DOM and the shortage of useful characterization methods, large knowledge gaps exist in our understanding of the interactions between DOM and ENPs. In this article, we systematically reviewed the interactions between DOM and ENPs, discussed the effects of DOM on the environmental behavior of ENPs, and described the changes in bioavailability and toxicity of ENPs caused by DOM. Critical evaluations of published references suggest further need for assessing and predicting the influences of DOM on the transport,transformation, bioavailability, and toxicity of ENPs in the environment.展开更多
Sulfamethoxypyridazine(SMP) is one of the commonly used sulfonamide antibiotics(SAs).SAs are mainly studied to undergo triplet-sensitized photodegradation in water under natural sunlight with other coexisting aqua...Sulfamethoxypyridazine(SMP) is one of the commonly used sulfonamide antibiotics(SAs).SAs are mainly studied to undergo triplet-sensitized photodegradation in water under natural sunlight with other coexisting aquatic environmental organic pollutants.In this work,SMP was selected as a representative of SAs.We studied the mechanisms of triplet-sensitized photodegradation of SMP and the influence of selected dissolved inorganic matter,i.e.,anions(Br^-,Cl^-,and NO^-_3) and cations ions(Ca^(2+),Mg^(2+),and Zn^(2+)) on SMP photodegradation mechanism by quantum chemical methods.In addition,the degradation mechanisms of SMP by hydroxyl radical(OH·) were also investigated.The creation of SO_2 extrusion product was accessed with two different energy pathways(pathway-1 and pathway-2) by following two steps(step-I and step-II) in the tripletsensitized photodegradation of SMP.Due to low activation energy,the pathway-1 was considered as the main pathway to obtain SO_2 extrusion product.Step-II of pathway-1 was measured to be the rate-limiting step(RLS) of SMP photodegradation mechanism and the effect of the selected anions and cations was estimated for this step.All selected anions and cations promoted photodegradation of SMP by dropping the activation energy of pathway-1.The estimated low activation energies of different degradation pathways of SMP with OH·radical indicate that OH·radical is a very powerful oxidizing agent for SMP degradation via attack through benzene derivative and pyridazine derivative ring.展开更多
文摘A discussion of the mechanism of nylon 6, 6 dissolving process using CaCl_2/MeOH as the sol-vent is presented. The calcium chloride forms a complex compound with nylon 6, 6 by breakingthe hydrogen bonds. The melting point of the CaCl_2 --nylon 6, 6 complex was found to be reducedby 91K relative to the pure nylon 6, 6 polymer. The role of methanol is somewhat similar to acatalyst. The results demonstrate that the complexation of a Lewis acid (CaCl_2) and a Lewis base(nylon 6, 6) can be used to probe intermolecular interactions such as hydrogen bonding in polymers, to modify the polymer properties and mediate its solubility and processing.
基金supported by the National Key Research and Development Program of China (2016YFA0203102)the National Natural Science Foundation of China (Nos. 21227012, 21337004, 21507147)
文摘Dissolved organic matter(DOM) is ubiquitous in the environment and has high reactivity.Once engineered nanoparticles(ENPs) are released into natural systems, interactions of DOM with ENPs may significantly affect the fate and transport of ENPs, as well as the bioavailability and toxicity of ENPs to organisms. However, because of the complexity of DOM and the shortage of useful characterization methods, large knowledge gaps exist in our understanding of the interactions between DOM and ENPs. In this article, we systematically reviewed the interactions between DOM and ENPs, discussed the effects of DOM on the environmental behavior of ENPs, and described the changes in bioavailability and toxicity of ENPs caused by DOM. Critical evaluations of published references suggest further need for assessing and predicting the influences of DOM on the transport,transformation, bioavailability, and toxicity of ENPs in the environment.
基金The financial support of the Natural Science Foundation of China(Nos.21137001 and 21373042)the Fundamental Research Funds for the Central Universities of China(DUT13RC(3)013)Chinese Scholarship Council(CSC)China and for the financial support
文摘Sulfamethoxypyridazine(SMP) is one of the commonly used sulfonamide antibiotics(SAs).SAs are mainly studied to undergo triplet-sensitized photodegradation in water under natural sunlight with other coexisting aquatic environmental organic pollutants.In this work,SMP was selected as a representative of SAs.We studied the mechanisms of triplet-sensitized photodegradation of SMP and the influence of selected dissolved inorganic matter,i.e.,anions(Br^-,Cl^-,and NO^-_3) and cations ions(Ca^(2+),Mg^(2+),and Zn^(2+)) on SMP photodegradation mechanism by quantum chemical methods.In addition,the degradation mechanisms of SMP by hydroxyl radical(OH·) were also investigated.The creation of SO_2 extrusion product was accessed with two different energy pathways(pathway-1 and pathway-2) by following two steps(step-I and step-II) in the tripletsensitized photodegradation of SMP.Due to low activation energy,the pathway-1 was considered as the main pathway to obtain SO_2 extrusion product.Step-II of pathway-1 was measured to be the rate-limiting step(RLS) of SMP photodegradation mechanism and the effect of the selected anions and cations was estimated for this step.All selected anions and cations promoted photodegradation of SMP by dropping the activation energy of pathway-1.The estimated low activation energies of different degradation pathways of SMP with OH·radical indicate that OH·radical is a very powerful oxidizing agent for SMP degradation via attack through benzene derivative and pyridazine derivative ring.