Calculation of the equilibrium constant of solutions containing platinum (Ⅱ) complex

来源 :1st International Conference on Computational Design and Sim | 被引量 : 0次 | 上传用户：huxiaoshenshan2010

【摘要】

：

Recently, there has been a growing interest towards palladium complexes as modulators of pharmacological activity in pharmaceuticals.Such substances can increase the effect and re-duce the overall tox

【作者】

：

MirSalim Asadov Asmet Azizova Sevinj Imamverdieva Dilgam Tagiyev

【机构】

：

Institute of Catalysis and Inorganic Chemistry, Azerbaijan National Academy of Sciences, H.Javid av.

【出处】

：

1st International Conference on Computational Design and Sim

【发表日期】

：

2015年9期

【关键词】

：

Calculating Constant of the complex Complex compound of palladium ion Pd(Ⅱ)

下载到本地 , 更方便阅读

下载此文赞助VIP

声明 : 本文档内容版权归属内容提供方 , 如果您对本文有版权争议 , 可与客服联系进行内容授权或下架

论文部分内容阅读

其他文献

Computational investigation of the structural and electronic properties of Gd-doped HfO2

The aggressive size downscaling of complementary metal-oxide-semiconductor (CMOS) transistors has led to the replacement of SiO2 by higher dielectric constant (k) oxides, such as HfO2.However, the ado

会议

High-k dielectric oxideFirst-principles calculationsIntrinsic defectsDoping

Catalytic activity of MS2 monolayer for hydrogen evolution

Promising results in hydrogen evolution reaction have been reported using 2H XS2 (S=Mo,W) nanoparticles with a high concentration of metallic edges, but the key challenges for XS2 are increasing the c

会议

Fermi surface of Sr2RuO4: Role of anisotropic Coulomb interaction and Coulomb-enhanced spin-orbit co

By using the local-density approximation + dynamical mean field theory method, we show that the Coulomb anisotropy and the correlation-enhanced spin-orbit coupling play a crucial role in determining t

会议

Progress in multi-scale modeling

Our early effort [1] in developing an integrated framework for multi-scale materials simulation and design focused on efficient information exchange between structure scales of multicomponent material

会议

Multi-scaleBuilding blocksMaterials genomeMicroscopic states

Modeling microstructure evolution during casting and homogenization heat treatment of industrial alu

In this contribution we are going to present our modeling activities on tracking microstructure evolution during casting and subsequent homogenization heat treatment of industrial aluminum alloys.Thre

会议

Efficiently annihilating vacancies near grain boundaries via competitive diffusion of interstitials

Grain boundaries (GBs) acting as defects sinks and defects annihilation catalysts determine the self-healing property of nano-crystal iron for radiation damage, which still remains poorly understood a

会议

Grain boundarySelf-healingRadiation damageInterstitial diffusion

Cocrystals of bioactive molecules

Computer prediction of the cocrystal (multicomponent molecular crystals) [1] structures is a relevant problem for computational material science [2,3].They are extremely promising for pharmaceutical i

会议

CocrystalsMolecular crystalsUSPEXCrystal structurePredictionEvolutionary al

Realization of a reversible switching in TaO2 polymorphs via Peierls distortion for resistance rando

Transition-metal-oxide based resistance random access memory (RRAM) is a promising candidate for next-generation universal non-volatile memories.Searching and designing appropriate materials used in t

会议

Lattice dynamics of Ti3C2 and Ti3C2T2 (T =O, F, OH) monosheets by first-principles calculations and

We present a comparative study on static and dynamical properties of bare Ti3C2 and T-terminated Ti3C2T2 (T =O, F, OH) monosheets using density functional theory calculations.First, the crystal struct

会议

Dynamical propertiesDensity functional theoryPhononRaman spectrum

Mechanical properties depending on valence electron concentration of tungsten alloys from first-prin

A systematic study of mechanical properties of tungsten alloys has been carded out using density function theory calculation.The influence of substitution of transition metal element (TM: Re, Ta,Hf, O

会议

Tungsten alloyValence electron concentrationIdeal tensile strengthMechanical

Calculation of the equilibrium constant of solutions containing platinum (Ⅱ) complex

与本文相关的学术论文