Computational Materials Science: An Introduction, Second Edition
Original PDF نویسندگان: June Gunn Lee
جزئیات
فرمت: Original PDF صفحات: 375 pages ناشر: CRC Press; 2nd edition (November 25, 2016) تاریخ انتشار نسخه الکترونیکی : November 25, 2016
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شابک: 9781138582552 لینک: https://www.amazon.com/dp/B07NZ8NBZQ
1,249,000 تومان
زمان تحویل: حداکثر 24 ساعت
توضیحات
This book covers the essentials of Computational Science and gives tools and techniques to solve materials science problems using molecular dynamics (MD) and first-principles methods. The new edition expands upon the density functional theory (DFT) and how the original DFT has advanced to a more accurate level by GGA+U and hybrid-functional methods. It offers 14 new worked examples in the LAMMPS, Quantum Espresso, VASP and MedeA-VASP programs, including computation of stress-strain behavior of Si-CNT composite, mean-squared displacement (MSD) of ZrO2-Y2O3, band structure and phonon spectra of silicon, and Mo-S battery system. It discusses methods once considered too expensive but that are now cost-effective. New examples also include various post-processed results using VESTA, VMD, VTST, and MedeA.
1,249,000 تومان
زمان تحویل: حداکثر 24 ساعت