Towards an atomic-scale understanding of crystal growth in solution.

نویسندگان

  • Elias Vlieg
  • Menno Deij
  • Daniel Kaminski
  • Hugo Meekes
  • Willem van Enckevort
چکیده

Our understanding of crystal growth continues to increase thanks to progress in theoretical models, computer simulations and experimental techniques. A discussion of the state-of-the-art in morphology prediction and of the determination of the solid-liquid interface structure using X-ray diffraction shows, however, that there is still a large gap between experiment and theory. We expect that computer modelling, in the form of both Molecular Dynamics simulations and first-principle calculations, will play a crucial role in filling this gap.

برای دانلود رایگان متن کامل این مقاله و بیش از 32 میلیون مقاله دیگر ابتدا ثبت نام کنید

ثبت نام

اگر عضو سایت هستید لطفا وارد حساب کاربری خود شوید

منابع مشابه

رشد بلور KDP در محلول آبی با افزودنی EDTA

Addition of EDTA to the KDP solution is an effective method to increase the stability zone and the crystal growth rate. EDTA neutralizes the chemical activity of metal ions impurity such as Al+3, Fe+3, Cr+3 (that exist in the chemical materials as impurity). Effect of Al+3, Fe+3, Cr+3 ions on the KDP crystal is investigated. Growth method was based on the “point seed” method following spontaneo...

متن کامل

Synthesis and Crystal Growth of Sb2S3 Nanorods Using Iodine as an Initiator Material via Electrochemical Mechanism in Hydrothermal Condition

Crystalline antimony sulfide (Sb2S3) with nanorods morphology was successfully prepared via hydrothermal method by the reaction of elemental sulfur, antimony and iodine as starting materials with high yield at 180°C for 24h.Using oxidation reagents like iodine as an initiator of redox reaction to prepare Sb2S3 is reported for first time. Crystal growth of Sb2S3 was done by increasing reaction t...

متن کامل

Quantum Chemical Investigations on C14C10-Branched-Chain Glucoside Isomers Towards Understanding Self-Assembly

Density Functional Theory (DFT) calculations have been carried out using a Polarizable Continuum Model (PCM) in an attempt to investigate the electro-molecular properties of branched-chain glucoside (C14C10-D-glucoside) isomers. The results showed that αconfiguration of pyranoside form is thermodynamically the most stable, while the solution should contain much more β...

متن کامل

Investigation of Different Stages of Aluminum Fluoride Crystal Growth

Crystallization of Aluminum fluoride at atmospheric pressure has been considered. Structure, size and shape of crystals formed during the crystallization process have been investigated. By applying the direct analysis method for the existed aluminum in solution, the aluminum fluoride nucleation process has been detected as a concentration valley at the outset of crystallization process. The...

متن کامل

نوع ساختمان منطقه‌ای ‌گارنت در اسکارنهای توده نفودی قهرود، جنوب کاشان

Next to the Ghohroud granitic intrusive body in the south of Kashan, skarns are outcropped, of which some contain garnet crystals with obvious zoning. In order to investigate characteristics of this zonation, garnet crystals were analyzed from core to rim by EDX point analysis, using scanning electron microscope. Obtained data show that garnet crystals belong to grandite (grassolar-andradite) s...

متن کامل

ذخیره در منابع من


  با ذخیره ی این منبع در منابع من، دسترسی به آن را برای استفاده های بعدی آسان تر کنید

عنوان ژورنال:
  • Faraday discussions

دوره 136  شماره 

صفحات  -

تاریخ انتشار 2007