Fast Reaction Research Articles

Ce-doped cobalt-based hydroxide assisted with low-temperature molten salt for industrial oxygen evolution reaction

Developing low cost and high-performance oxygen evolution electrocatalysts is significant to improve the efficiency of water electrolysis for large-scale hydrogen production. Cobalt hydroxide is a promising electrocatalyst for oxygen evolution reaction (OER), but its poor conductivity and activity seriously restrict the practical application. A simple one-step low temperature molten salt method was applied to successfully synthesize the Ce-doped cobalt hydroxide nitrate (Ce-CoNH/CF), which exhibits outstanding OER performance with a low overpotential of 448 mV at the current density of 1000 mA/cm2 in 1 mol/L KOH. The remarkable performance of Ce-CoNH/CF electrode in OER may be the comprehensive result of fast reaction kinetics, large electrochemical active specific surface area (ECSA) and small charge transfer resistance (Rct) as revealed by the Tafel, cyclic voltammetry (CV) and electrochemical impedance spectra (EIS) analysis. Under the simulated industrial test conditions (6 mol/L KOH, 70 °C), the Ce-CoNH/CF electrode still displays excellent OER performance.

Multifunctional Interface Layer Constructed by Trace Zwitterions for Highly Reversible Zinc Anodes.

The inhomogeneous plating/stripping of Zn anode, attributed to dendrite growth and parasitic reactions at the electrode/electrolyte interface, severely restricts its cycling life-span. Here, trace zwitterions (trifluoroacetate pyridine, TFAPD) are introduced into the aqueous electrolyte to construct a multifunctional interface that enhances the reversibility of Zn anode. The TFA- anions with strong specific adsorption adhere onto the Zn surface to reconstruct the inner Helmholtz plane (IHP), preventing the hydrogen evolution and corrosion side reactions caused by free H2O. The Py+ cations accumulate on the outer Helmholtz plane (OHP) of Zn anode with the force of electric field during Zn2+ plating, forming a shielding layer to uniformize the deposition of Zn2+. Besides, the adsorbed TFA- and Py+ promote the desolvation process of Zn2+ resulting in fast reaction kinetics. Thus, the Zn||Zn cells present an outstanding cycling performance of more than 10000 hours. And even at 85% utilization rate of Zn, it can stably cycle for over 200 hours at 10 mA cm-2 and 10 mAh cm-2. The Zn||I2 full cell exhibits a capacity retention of over 95% even after 30000 cycles. Remarkably, the Zn||I2 pouch cells (95 mAh) deliver a high-capacity retention of 99% after 750 cycles.

Electrocatalytic oxygen reduction at non-metalated and pyrolysis free hypercrosslinked polymers

Oxygen reduction is one of the core steps of non-emissive zero carbon energy conversion. Therefore, enhancement of its sluggish kinetics is extremely important. Very recently researchers focused on oxygen electrocatalysis at porous polymers. Here we applied the non-metalated and pyrolysis free hypercrosslinked polymers with high specific surface area and abundant active sites. Electrode modified with the copolymer prepared from the twisted triphenylbenzene and N containing triphenyl amine exhibits electrocatalytic ORR in alkaline medium. Tafel slope value (0.067 V dec−1) indicates the efficient electrocatalytic activity and fast reaction kinetics. The lack of H2O2 product detected by scanning electrochemical microscopy suggests 4-electron path. The electrocatalytic activity of electrodes modified with hypercrosslinked polymers prepared from single monomers is also seen.

Corundum-quartz metastability: the role of silicon diffusion in corundum

The synthesis of the Al2SiO5 polymorphs kyanite, sillimanite and andalusite in a pure Al2O3–SiO2–H2O (ASH) system has long been known to be impeded. In order to decipher individual aspects of the reaction: corundum + SiO2aq, which repeatedly fails to produce thermodynamically stable Al2SiO5, we conducted experiments within the stability fields of kyanite and sillimanite (500–800 ℃; 0.2–1 GPa) with the aim of forming reaction coronas on corundum. Results showed that metastable corundum + quartz assemblages form persistently in pure ASH, even in Al2SiO5 seeded experiments, despite the presence of catalyzing fluid and evidence of fast reaction kinetics. Coronas on corundum spontaneously formed when additional components (Na, K, N, and Mg) were added to the experiment. In a similar experiment with baddeleyite (ZrO2) instead of corundum in silica saturated water, a zircon corona formed readily. This implies that nucleation and growth of Al2SiO5 is obstructed under conditions of Al and Si saturation in aqueous fluid, while both corundum and quartz saturated aqueous fluid are willing participants in other reactions towards stable corona formation. Instead of Al2SiO5 precipitation, an unexpected fluid-aided silica diffusion process into corundum was documented. The latter included the formation of nanometer wide hydrous silicate layers along the basal plane of the corundum host, which enhanced the silica diffusion rate drastically, leading to silica supersaturation in the host mineral, and ultimately to precipitation of quartz inside corundum. We conclude that the natural metastable assemblage of quartz and corundum is not necessarily the result of dry or fluid absent conditions, given that the aqueous fluid in experiments does not promote Al2SiO5 formation, but rather seems to support the formation and preservation of a metastable assemblage.

Highly porous activated carbon derived from plant raw material as high-performance anode for aqueous sodium-ion supercapacitors

High power sodium energy generation devices, such as symmetric and hybrid supercapacitors, have great potential for cheap and green post-lithium applications. However, it is imperative to obtain porous structures with large surfaces and optimized pore size to enhance the electrode sorption property and to ensure fast electrochemical reactions. In this work, we investigated the influence of KOH carbon activation conditions on the morphology, porosity, and electrochemical parameters in aqueous sodium electrolytes. Our activated carbon had a maximum surface area of 1556 m2/g and a notably high mesopore content, this varying from 5 to 19 % of the total pore area. Electrochemical parameters are not only influenced by the total number of pores, but also by the optimal ratio of meso and micro pores. It is shown that in the case of sodium-based electrolytes, mesopores provide good electrode-electrolyte contact, and the capacity is mainly provided by micropores. High operating values of activated carbon in sodium aqueous electrolytes (specific capacity about 78 F/g, energy density 11 W*h/kg and power density 470 W/kg) indicates that the optimal electrode materials for a high-power device are activated carbon with a high content of mesopores obtained by the ratio of C and KOH as 1:4.

Electrospun metal-organic framework materials derived bimetallic oxides as high-efficiency anodes for lithium-ion battery

Energy devices are receiving more and more attention, and this is especially true for lithium-ion batteries. Moreover, applying novel nanostructures in multicomponent systems is a very effective way to promote the development of energy storage systems. This study synthesizes a nitrogen-doped carbon nanofiber encapsulating MOF-derived bimetallic oxide nanomaterial by combining electrospinning and MOF materials. Nitrogen-doped carbon nanofibers are porous and highly conductive, providing structural stability, a practical pathway for lithium ion diffusion, and an essential channel for rapid charge transfer during cycling. The bimetallic oxides derived from the MOF materials provide sufficient space for fast reaction sites and mitigate volume expansion during cycling. When the composite material FNO@NCNFs is used as the anode material for lithium batteries, its reversible capacity is maintained at 1105.4 mAh g−1 after 100 cycles at a current density of 0.1 A g−1. Its capacity reaches 748.5 mAh g−1 after 900 cycles at a current density of 1 A g−1, and at the same time, it exhibits excellent cycling stability, with the coulombic efficiency remaining above 98 %. The material also exhibits a small ion transfer resistance and good rate performance. The structural design approach based on combining MOFs with electrospinning in this study will provide new insights into the design and development of materials for advanced energy storage applications.

Crystalline/Amorphous Co2P2O7 cathode with outstanding areal capacity for High-Performance Zinc-Cobalt battery

It is still a challenge to develop aqueous rechargeable Zn-based alkaline batteries with high energy density, power density and excellent stability. Herein, a crystalline/amorphous Co2P2O7 self-supporting on the Ni foam is fabricated as a cathode material of aqueous Zn-based alkaline batteries. The unique crystalline/amorphous structure endows the electrode material with more exposed active sites, higher redox species coverage, larger electrochemical surface area (ECSA), smaller charge-transfer resistance, lower reaction energy barriers and faster electrochemical reaction kinetics process, which clarifies an explicit structure–property relationship simultaneously. As a result, the crystalline/amorphous Co2P2O7 (CP-P-450) electrode assembled as CP-P-450//Zn battery achieves an extraordinary areal capacity of 2.49 mAh cm−2 at 5 mA cm−2, satisfactory rate performance, excellent cyclic durability (96.6 % retention after 4000 cycles) and impressive energy density (4.16 mAh cm−2) and peak power density (115.94 mW cm−2). The quasi-solid CP-P-450//Zn battery can drive a variety of electrical appliances working well even under abuse tests, demonstrating excellent safety and application potential. This study provides an effective strategy towards excellent comprehensive energy storage performance of aqueous Zn-based alkaline batteries through structuring the crystalline/amorphous phase in cathodes.

A Systematic Study on Biobased Epoxy-Alcohol Networks: Highlighting the Advantage of Step-Growth Polyaddition over Chain-Growth Cationic Photopolymerization.

Vanillyl alcohol has emerged as a widely used building block for the development of biobased monomers. More specifically, the cationic (photo-)polymerization of the respective diglycidyl ether (DGEVA) is known to produce materials of outstanding thermomechanical performance. Generally, chain transfer agents (CTAs) are of interest in cationic resins not only because they lead to more homogeneous polymer networks but also because they strikingly improve the polymerization speed. Herein, the aim is to compare the cationic chain-growth photopolymerization with the thermally initiated anionic step-growth polymerization, with and without the addition of CTAs. Indeed, CTAs lead to faster polymerization reactions as well as the formation of more homogeneous networks, especially in the case of the thermal anionic step-growth polymerization. Resulting from curing above the TG of the respective anionic step-growth polymer, materials with outstanding tensile toughness (>5MJ cm-3) are obtained that result in the manufacture of potential shape-memory polymers.

Highly efficient remediation of Sb-contaminated mine drainage using nano-calcium peroxide induced co-precipitation treatment

Antimony (Sb) mines provide an important metalloid to support the electronic industry but also leave extensive leakage into the aqueous environment. The toxic and carcinogenic heavy metal Sb from mine drainage constitutes a major source of groundwater and soil contamination, indicating intense demands for the environmental-friendly and cost-effective technology to achieve effective remediation. The emerging nanotechnology represents a new technological prospect. In this study, nano-calcium peroxide (nano-CaO2, 8–24 nm) was successfully fabricated by an optimized pH-regulated chemical precipitation method and was used for the lab-based experiments of nano-remediation, with the Sb-contaminated mine drainage collected on-site from an abandoned mine cavern in the Qingjiagou Antimony Mine, Henan Province, China. It is demonstrated that the specifically prepared nanoscale CaO2 has better solubility and faster reaction rates than the commercial CaO2, resulting in promising effect for the nano-remediation of Sb-contaminated groundwater. 97.8 % of an initial 2.8 mg/L Sb contamination was removed in 5 min under the optimum conditions, consisting of 0.5 mg/mL CaO2, 1.0 mg/mL polymeric ferric sulfate (PFS), an oscillation frequency of 120 rpm and a temperature of 298 K. The batch experiments revealed that the initial pH, oscillation frequency, temperature and illumination, as well as hydro-chemical competing ions (i.e., K+, Na+, Ca2+, Mg2+, Mn2+, SO42−, NO3− and Cl−) of the real groundwater all hardly affected the removal efficiency. However, the existence of HCO3− could lead to an obvious impact on the treatment as it would react with the generated OH.

Multifunctional electrochromic yarns for variable optical and thermal regulation

In this study, tungsten oxide and polyaniline hybrid films were deposited on the surface of stainless steel yarns by electrochemical deposition, and the electrochromic yarns with double electrochromic layer structure were formed. WO3 acts as a protective layer and binder to connect PANI nanorods, thereby improving electrochemical stability and electrochromic performance. The electrochromic yarns present five color changes in the voltage range of −0.4 V-1.1 V, the optical modulation of 59.98 %, the response time of 0.75 s, the coloration efficiency of 74.89 cm2/C, good electrochemical cycling stability (100 cycles without significant degeneration) and washing durability. At the same time, stable electrochromic behavior is still maintained in the bending state. The device based electrochromic yarns also has reversible multi-color variation, fast reaction time, and long-term stability. What's more, the device can be embroidered or woven into the fabric and designed into patterns of different colors. More color combinations can be achieved by adjusting the voltage. Finally, the fabric based on multifunction electrochromic yarns are used to study the thermal shielding performance. It can effectively block thermal radiation. These results indicate that the electrochromic yarn has promising potential for high-performance optical and thermal regulation applications. This research provides a prospective strategy for constructing multifunctional electronic devices in wearable application.

Fast Reaction of the Prussian Blue Based Nanozyme "Artificial Peroxidase" with the Substrates: Pre-Steady-State Kinetic Approach.

This letter introduces the pre-steady-state kinetic approach, which is traditional for evaluation of elementary constants in molecular (enzyme) catalysis, for nanozymes. Apparently, the most active peroxidase-mimicking nanozyme based on catalytically synthesized Prussian Blue nanoparticles has been chosen. The elementary constants (k1) for the nanozymes' reduction by an electron-donor substrate (being the fastest stage according to steady-state kinetic data) have been determined by means of stopped-flow spectroscopy. These constants have been found to be dependent on both the size of the nanozyme and the reducing substrate redox potential. For the smallest nanozymes (32 nm in diameter), log(k1) linearly decays with an increase of the substrate redox potential (cotangent value ≈125 mV). On the contrary, for the largest nanozymes with a diameter above 150 nm, k1 is almost independent of it. Moreover, for the substrate with the lowest redox potential (K4[Fe(CN)6]), the rate constant under discussion (k1) is almost independent of the nanozymes' size. Perhaps, the rate of the intrananozyme electron transfer causing bleaching becomes comparative or even lower than that of the nanoparticle interaction with the fastest substrate. Anyway, the elementary constant of nanozyme reduction with potassium ferrocyanide (k1) reaches the value of 1 × 1010 M-1 s-1, which is 3-4 orders of magnitude faster than for enzymes peroxidases. The obtained results obviously demonstrate that the pre-steady-state kinetic approach is able to discover novel advantages of nanozymes from both fundamental and practical points of view.

Synthesis of Porous Carbon Honeycomb Structures Derived from Hemp for Hybrid Supercapacitors with Improved Electrochemistry.

Energy storage in electrochemical hybrid capacitors involves fast faradaic reactions such as an intercalation, or redox process occurring at a solid electrode surface at an appropriate potential. Hybrid sodium-ion electrochemical capacitors bring the advantages of both the high specific power of capacitors and the high specific energy of batteries, where activated carbon serves as a critical electrode material. Herein, we have demonstrated that a porous honeycomb structure activated carbon derived from Australian hemp hurd (Cannabis sativa L.) in aqueous Na2SO4 electrolyte showed a specific capacitance of 240 F/g at 1 A/g.The hybrid sodium-ion device employing hemp-derived activated carbon (HAC) coupled with electrolytic manganese dioxide (EMD) in an aqueous Na2SO4 electrolyte showed a specific capacitance of 95 F/g at 1 A/g having a capacitance retention of 90%. The hybrid device (HAC||EMD) can possess excellent electrochemical performance metrics, having a high energy density of 38 Wh/kg at a power density of 761 W/kg. Overall, this study provides insights into the influence of the activation temperature and the KOH impregnation ratio on morphology, porosity distribution, and the activated carbon's electrochemical properties with faster kinetics. The high cell voltage for the device is devoted to the EMD electrode.

Biphasic Production of 5-hydroxymethylfurfural (HMF) in a Recyclable Deep Eutectic Solvent-based System Catalyzed by H4SiW12O40.

The reaction with in situ extraction to yield 5-hydroxymethylfurfural (HMF) from Fru was investigated using a biphasic system based on a self-consuming deep eutectic solvent (DES) as reaction phase. The significance of choline chloride (ChCl), a cost-effective and safe quaternary ammonium salt, was evident in enhancing 5-HMF yield through fructose dehydration and concurrently suppressing side reactions. The DES system demonstrated fast reactions with high selecivities and recyclability across five cycles. The observed decline in H4SiW12O40 activity, primarily due to proton leaching, was successfully restored with the addition of HCl. Furthermore, ChCl exhibited ease of recrystallization in the presence of acetonitrile. This research proposes an environmentally friendly approach for 5-HMF production through a reusable-biphasic process. The presented reaction system suppresses completely the formation of levulinic and formic acid leading to HMF yields of up to 84% of selectivities of up to 88% after 30 minutes at 80 °C. The system was recycled over 16 runs and after an initial slight loss of activity the system in the run 0-5, run 6-15 has shown a constant HMF output as in the first recycling run.

In-situ synthesis to promote surface reconstruction of metal–organic frameworks for high-performance water/seawater oxidation

Metal-organic frameworks (MOFs) have gained tremendous notice for the application in alkaline water/seawater oxidation due to their tunable structures and abundant accessible metal sites. However, exploring cost-effective oxygen evolution reaction (OER) electrocatalysts with high catalytic activity and excellent stability remains a great challenge. In this work, a promising strategy is proposed to regulate the crystalline structures and electronic properties of NiFe-metal-organic frameworks (NiFe-MOFs) by altering the organic ligands. As a representative sample, NiFe-BDC (BDC: C8H6O4) synthesized on nickel foam (NF) shows extraordinary OER activity in alkaline condition, delivering ultralow overpotentials of 204, 234 and 273 mV at 10, 100, and 300 mA cm−2, respectively, with a small Tafel slope of 21.6 mV dec−1. Only a slight decrease is observed when operating in alkaline seawater. The potential attenuation is barely identified at 200 mA cm−2 over 200 h continuous test, indicating the remarkable stability and corrosion resistance. In-situ measurements indicate that initial Ni2+/Fe2+ goes through oxidation process into Ni3+/Fe3+ during OER, and eventually presents in the form of NiFeOOH/NiFe-BDC heterojunction. The unique self-reconstructed surface is responsible for the low reaction barrier and fast reaction kinetics. This work provides an effective strategy to develop efficient MOF-based electrocatalysts and an insightful view on the dynamic structural evolution during OER.

Thermal vapor sulfurization of Ti3C2TX MXene to TiS2/carbon nanosheet cathode for long-life and high-loading all-solid-state lithium batteries

Stable and fast operation of all-solid-state lithium batteries (ASSBs) depends on durable and sufficient interfacial contacts between electrode components, especially when the loading and content of electrode active materials are high. Here, we propose promoting ionic/electronic transportations and contacts in sulfide electrolyte-based ASSBs by using TiS2/carbon nanosheets (TiS2/C-s) with large area-to-thickness aspect ratios as the cathode, which are prepared by simple thermal vapor sulfurization of exfoliated Ti3C2Tx MXene. The elastic 2D structure of the TiS2/C-s material can substantially improve interfacial contact with the solid electrolyte, minimize the diffusion distance of lithium ions, and buffer volume/stress changes during cycling, thereby ensuring the electro-chemo-mechanical stability and fast reaction kinetics of electrodes. Consequently, a 50 wt% TiS2/C-s cathode without any conductive carbon additives demonstrates a high discharge capacity (295 mAh g−1), long-term cyclic stability (94.7 and 74.7 % capacity retention after 250 cycles at 0.1 mA cm−2 and after 2300 cycles at 1 mA cm−2, respectively), and decent rate capability (126.0 mAh g−1 at 3 mA cm−2). Moreover, stable cycling with a high areal capacity (5.95 mAh cm−2) can also be achieved.

Anti-windup strategies for biomolecular control systems facilitated by model reduction theory for sequestration networks.

Robust perfect adaptation, a system property whereby a variable adapts to persistent perturbations at steady state, has been recently realized in living cells using genetic integral controllers. In certain scenarios, such controllers may lead to "integral windup," an adverse condition caused by saturating control elements, which manifests as error accumulation, poor dynamic performance, or instabilities. To mitigate this effect, we here introduce several biomolecular anti-windup topologies and link them to control-theoretic anti-windup strategies. This is achieved using a novel model reduction theory that we develop for reaction networks with fast sequestration reactions. We then show how the anti-windup topologies can be realized as reaction networks and propose intein-based genetic designs for their implementation. We validate our designs through simulations on various biological systems, including models of patients with type I diabetes and advanced biomolecular proportional-integral-derivative (PID) controllers, demonstrating their efficacy in mitigating windup effects and ensuring safety.

Engineering Oxygen Vacancies of Co-Mn-Ni-Fe-Al High-Entropy Spinel Oxides by Adjusting Co Content for Enhanced Catalytic Combustion of Propane.

Transition metal-based oxides with similar oxidation activities for catalytic hydrocarbon combustion have attracted much attention. In this study, a new class of metal high-entropy oxides (CoxMnNiFeAl)3O4 (x = 1, 2, 3, 4, 5) with a porous structure was fabricated through a simple and inexpensive NaCl template-assisted sol-gel approach, which was employed for the catalytic oxidation of propane. The results indicated that the content of cobalt has a great impact on its activity, and the (Co4MnNiFeAl)3O4 catalyst exhibited the best catalytic activity. At the high space velocity of 60 000 mL·g-1·h-1, the optimized one with high-temperature treatment can still achieve 90% propane conversion at 309 °C, which is 68 and 178 °C lower than those of the (CoMnNiFeAl)3O4 catalyst and pure cobalt oxide, respectively. Meanwhile, it has the lowest apparent activation energy (46.6 KJ·mol-1) and the fastest reaction rate (26.976 × 10-6 mol·gcat-1·s-1 at 290 °C). The improved performance of the (Co4MnNiFeAl)3O4 catalyst could be attributed to the enhancement of low-temperature reducibility, the increased number of reactive surface oxygen species, and the cocktail effect of the high-entropy oxides. This work provides new insights into the preparation of efficient light alkane degradation catalysts and a realistic approach for the large-scale application of high-entropy oxides in the field of oxidation catalysts.

A water-soluble colorimetric and turn-on fluorescence sensor for fast and sensitive detection of sulfite/bisulfite ions in real samples and live cells

Consuming an excessive amount of sulfites can have detrimental effects on human health. Therefore, it is essential to develop an effective technique to detect the presence of HSO3− in food samples and live cells. Herein, we have developed a colorimetric and turn-on fluorescent probe PI capable of efficiently detecting sulfite/ bisulfite (SO32− /HSO3−) in aqueous PBS buffer (pH 7.4). This probe PI is non-fluorescent due to intramolecular charge transfer (ICT), but becomes fluorescent in the presence of HSO3−. The reaction between SO32− /HSO3− and the probe disrupts π - conjugation by a nucleophilic addition mechanism, resulting in the inhibition of intramolecular charge transfer (ICT). This leads to changes in both the fluorescence and absorption spectra. The color of the probe PI changed from blue to colorless, making it easier to detect HSO3−with the naked eye. Our probe also demonstrates excellent sensitivity, selectivity, fast (reaction completed in 300 s), and a low limit of detection (LOD = 8.4 nM). Furthermore, it is effective in detecting levels of SO32− /HSO3− in water, sugar, and MDA-MB-231 live cancer cells.

Photocatalytically active layered double hydroxide-PVDF composite membranes for effective remediation of dyes contaminated water

In this work, polyvinylidene fluoride (PVDF) intercalated CuFe layered double hydroxides (LDH) membranes were fabricated and investigated for UV-LED/persulfate degradation of methylene blue (MB), crystal violet (CV), methyl orange (MO), and Eriochrome black T (EBT) dyes from water. The PVDF-CuFe membrane exhibited improved heterogeneity, surface functionality (CuO, Fe–O, Cu–O–Fe), surface roughness, and hydrophilicity. The process parameters were optimized by response surface methodology, and maximum MB removal (100%) was achieved within 45.22–178.5 min at MB concentration (29.45–101.93 mg/L), PP concentration (0.5–2.41 g/L) and catalyst dosage (1.84–1.95 g/L). The degradation kinetics was well described by a pseudo-first-order model (R2 = 0.982) and fast reaction rate (0.029–0.089/min). The MB dye degradation mechanism is associated with HO·/SO4•− reactive species generated by Fe3+/Fe2+ or Cu2+/Cu+ in PVDF-CuFe membrane and PP dissociation. The PVDF-CuFe membrane demonstrated excellent recyclability performance with a 12% reduction after five consecutive cycles. The catalytic membrane showed excellent photocatalytic degradation of crystal violet (100%), methyl orange (79%), and Eriochrome black T (60%). The results showed that UV-LED/persulfate-assisted PVDF-CuFe membranes can be used as a recyclable catalyst for the effective degradation of dye-contaminated water streams.

Nitrogen-Doped Carbon and Metal-Nitrogen-Carbon Materials as Cathode Hosts for Li-S Batteries: Experimental Study and Mechanism Analysis.

Both nitrogen-doped carbon (NC) and metal-nitrogen-carbon (MNC) materials have been extensively investigated in lithium-sulfur batteries to alleviate the "shuttle effect". MNC are generally synthesized using NC as the parent material, wherein nitrogen atoms in NC serve as the "bridge" to coordinate with metal atoms. So far, an important scientific issue has not been settled: does the introduction of metal sites into NC certainly enhance the Li-S battery performance? In this work, NC and MNC materials derived from the same precursor, a nitrogen-rich porous polymer, are systematically compared as cathode hosts for Li-S battery through theoretical calculations and experimental investigation. Li-S cell with NC as the cathode sulfur host exhibits better cycle performance at low current densities (0.1 and 0.2C), whereas MNC materials predominate at higher current densities (such as 1C and 2C). Based on theoretical calculation and experimental results, it is concluded that the introduction of metal sites into NC through nitrogen bonding promoted the catalytic capability for faster sulfur redox reaction kinetics, whereas the adsorption energy toward polysulfides decreased. This work provides important guidance for more targeted design of advanced materials for lithium-sulfur battery application in the future.