অনুসন্ধান ফলাফলগুলি - "density functional theory"

  • প্রদর্শন 1 - 8 ফলাফল এর 8
ফলাফল পরিমার্জন করুন
  1. 1

    Estudio ter̤ico de las propiedades els̀ticas de los minerales Cu3TMSe4 (TM = V, Nb, Ta) por medio de cl̀culos atoms̕ticos de primeros principios

    বিষয়গুলি: “…Elastic properties; Elastic constants; Mechanical properties; Density functional theory.…”
    Estudio ter̤ico de las propiedades els̀ticas de los minerales Cu3TMSe4 (TM = V, Nb, Ta) por medio de cl̀culos atoms̕ticos de primeros principios
    গ্রন্থ
  2. 2

    Theoretical Understanding of Stability of Alloys for Hard-coating Applications and Design

    বিষয়গুলি:
    Theoretical Understanding of Stability of Alloys for Hard-coating Applications and Design
    গ্রন্থ
  3. 3

    Influence of Si Atoms Insertion on the Formation of the Ti-Si-N Composite by DFT Simulation

    বিষয়গুলি:
    Influence of Si Atoms Insertion on the Formation of the Ti-Si-N Composite by DFT Simulation
    গ্রন্থ
  4. 4

    Proton transfer from 1,4-pentadiene to superoxide radical anion , a QTAIM analysis

    বিষয়গুলি:
    Proton transfer from 1,4-pentadiene to superoxide radical anion , a QTAIM analysis
    গ্রন্থ
  5. 5
  6. 6

    Computational Modeling of the Electrical Sensing Properties of Single Wall Carbon Nanotubes

    বিষয়গুলি:
    Computational Modeling of the Electrical Sensing Properties of Single Wall Carbon Nanotubes
    গ্রন্থ
  7. 7

    From the Electronic Structure of Point Defects to Functional Properties of Metals and Ceramics

    বিষয়গুলি:
    From the Electronic Structure of Point Defects to Functional Properties of Metals and Ceramics
    গ্রন্থ
  8. 8

    Theoretical and Experimental Studies of Surface and Interfacial Phenomena Involving Steel Surfaces

    বিষয়গুলি:
    Theoretical and Experimental Studies of Surface and Interfacial Phenomena Involving Steel Surfaces
    গ্রন্থ