Mean field theories for the description of diffusion and phase transformations controlled by diffusion
文献情報
A self-consistent mean field (SCMF) theory starting from an atomic diffusion model can predict most of the correlation effects induced by the vacancy diffusion mechanism while being coherent with thermodynamics. For that purpose a time dependent effective Hamiltonian is introduced into the non-equilibrium distribution function. Such effective Hamiltonian makes a new hierarchy of approximations to appear in parallel to the thermodynamic mean-field approximations. We explain how each level of approximation is related to correlation effects and how kinetics of phase transformation results from both thermodynamics and diffusion properties. A first example is the radiation induced segregation (RIS) at grain boundary (GB) in austenitic steels where thermodynamics is shown to play an important role under irradiation. In a second example, we demonstrate how mean-field approximations combined with mesoscopic theories like the classical nucleation theory can describe the kinetics of precipitation, leading to a prediction of the cluster size distributions in the solid solution and of the steady state nucleation rates in agreement with kinetic Monte Carlo simulations.
関連文献
A universal tumor cell isolation method enabled by fibrin-coated microchannels
Jinling Zhang
DOI: 10.1039/C5AN01783A
An ultrasensitive and simple assay for the Hepatitis C virus using a reduced graphene oxide-assisted hybridization chain reaction
Jialong Fan, Liqun Yuan, Qingxin Liu, Chunyi Tong, Wenmiao Wang, Feng Xiao, Bin Liu, Xuanming Liu
DOI: 10.1039/C9AN00179D
Colorimetric switchable linker-based bioassay for ultrasensitive detection of prostate-specific antigen as a cancer biomarker
Jungwoo Hahn, Eunghee Kim, Youngsang You
DOI: 10.1039/C9AN00552H
Mass spectrometry of modified RNAs: recent developments
Collin Wetzel, Patrick A. Limbach
DOI: 10.1039/C5AN01797A
Serum-based differentiation between multiple sclerosis and amyotrophic lateral sclerosis by Random Forest classification of FTIR spectra
Youssef El Khoury, Vildan Gulsari, Christine Patte-Mensah, Gilles Marcou, Alexandre Varnek, Ayikoé Guy Mensah-Nyagan
DOI: 10.1039/C9AN00754G
Multiplexed ELISA screening assay for nine paralytic shellfish toxins in human plasma
Padmanabhan Eangoor, Amruta Sanjay Indapurkar, Mani Deepika Vakkalanka, Jennifer Sporty Knaack
DOI: 10.1039/C9AN00494G
A new approach to preparation of antisense oligonucleotide samples with microextraction by packed sorbent
Łukasz Nuckowski, Anna Kaczmarkiewicz, Sylwia Studzińska, Bogusław Buszewski
DOI: 10.1039/C9AN00740G
Visualization of biosensors using enhanced surface plasmon resonances in capped silver nanostructures
Kuang-Li Lee, Meng-Lin You, Cheng-Lin Tsai, Chia-Yu Hung, Shu-Yi Hsieh
DOI: 10.1039/C5AN02063H
Clinical evaluation of a novel microfluidic device for epitope-independent enrichment of circulating tumour cells in patients with small cell lung cancer
Jakub Chudziak, Deborah J. Burt, Sumitra Mohan, Dominic G. Rothwell, Bárbara Mesquita, Jenny Antonello, Suzanne Dalby, Mahmood Ayub, Lynsey Priest, Louise Carter, Matthew G. Krebs, Caroline Dive, Ged Brady
DOI: 10.1039/C5AN02156A
こちらもおすすめ
3-(5-フェニル-2-ファイル)-プロパン酸の市場動向や研究トレンドはどうですか?
この化合物の市場動向は不明ですが、類似化合物の需要は化学繊維、医薬品、農薬分野で安定しています。研究トレンドとしては、該当化合物の生物学的活性の評価や、その他の...
3- Chloro-1H-indazol-5-olはどのように保存すればよいですか?
3- チロロ-1H-吲唑-5-醇は遮光し、直射日光を避けて、温度は室温を推奨し、密閉容器に保存してください。
L-(1-~13~C)メチオニンの市場動向や研究トレンドはどうですか?
L-(1-~13~C)メチオニンは、医薬品やバイオテクノロジー分野での研究が増加しており、その価格は安定しています。新興研究分野では、代謝解析や遺伝子機能解析で...
1,3-フェニレンビスメチレンビスアクリレートは安全ですか?
1,3-フェニレンビスメチレンビスアクリレートは一般的に安全ですが、直接皮膚に触れる場合は保護用具を使用することを推奨します。高濃度の蒸気が吸入された場合は呼吸...
丹参醇Aはどのように保存すればよいですか?
丹参醇Aは、直射日光を避けて室温で保存し、密栓容器に入れることをお勧めします。適切な保存条件は、安定性を保ち、安全性を確保する上で重要です。
4-メチル-2-(1,1,1-三フロロ-2-メチルプロパニル)ピリドインとは何ですか?
CAS番号1378865-93-0の4-メチル-2-(1,1,1-三フロロ-2-メチルプロパニル)ピリドインは、合成化学分野で用いられる有機化合物の一種です。こ...
N-フェニルベンジル-2-クロロ酢氨を取り扱う際の実験室安全事項は何ですか?
N-フェニルベンジル-2-クロロ酢氨は毒性があり、皮膚や粘膜に刺激を与えます。取り扱う際には、保護眼鏡、手袋、ゴーグルを着用することを強く推奨します。ドラフトチ...
UCN-02を取り扱う際の実験室安全事項は何ですか?
UCN-02は毒性は低いですが、人体への直接的な接触は避けるべきです。PPE要件はグローブと顔面保護具を着用することです。ドラフトチャンバーを使用して漏洩を処理...
N-[3-[2-(二甲基氨基)乙氧基]-4-甲氧基苯基]-2'-甲基-4'-(5-甲基-1,2,4-恶二唑-3-基)-[1,1'-联苯]-4-甲酰胺を取り扱う際の実験室安全事項は何ですか?
手袋と保護眼鏡を着用し、漏洩時には吸気防止装置を使用してください。室温、乾燥した場所に保管し、直日光から隔離してください。SDS(安全データシート)を参照してく...
掲載誌
Physical Chemistry Chemical Physics

Physical Chemistry Chemical Physics (PCCP) is an international journal co-owned by 19 physical chemistry and physics societies from around the world. This journal publishes original, cutting-edge research in physical chemistry, chemical physics and biophysical chemistry. To be suitable for publication in PCCP, articles must include significant innovation and/or insight into physical chemistry; this is the most important criterion that reviewers and Editors will judge against when evaluating submissions. The journal has a broad scope and welcomes contributions spanning experiment, theory, computation and data science. Topical coverage includes spectroscopy, dynamics, kinetics, statistical mechanics, thermodynamics, electrochemistry, catalysis, surface science, quantum mechanics, quantum computing and machine learning. Interdisciplinary research areas such as polymers and soft matter, materials, nanoscience, energy, surfaces/interfaces, and biophysical chemistry are welcomed if they demonstrate significant innovation and/or insight into physical chemistry. Joined experimental/theoretical studies are particularly appreciated when complementary and based on up-to-date approaches.












![5-Bromoimidazo[1,2-a]pyridine structure 5-Bromoimidazo[1,2-a]pyridine structure](https://static.chemtradehub.com/structs/692/69214-09-1-d8e2.webp)
![(2S)-2-({[(2-Methyl-2-propanyl)oxy]carbonyl}amino)-4-pentynoic acid structure (2S)-2-({[(2-Methyl-2-propanyl)oxy]carbonyl}amino)-4-pentynoic acid structure](https://static.chemtradehub.com/structs/630/63039-48-5-b66d.webp)
