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  1. 181
    Studying Soft Interfaces with Shear Waves: Principles and Applications of the Quartz Crystal Microbalance (QCM)
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    Article
  2. 182
    First-principles study of the oxygen evolution reaction of lithium peroxide in the lithium-air battery
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    Article
  3. 183
    Impact of Electronic State Mixing on the Photoisomerization Timescale of Natural and Synthetic Molecular Systems
    by Manathunga, Madushanka
    Published 2018
    Subjects: “...Physical Chemistry...”
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  4. 184
    Tailoring the Band Gap in Codoped GaN Nanosheet From First Principle Calculations
    by Changjiao Ke, Chunling Tian, Yundan Gan
    Published 2020-06-01
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    Article
  5. 185
    Magnetic anisotropy of ultrathin Pd4Co(111) film by first-principles calculations
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    Article
  6. 186
    Chemometrics Methods for Specificity, Authenticity and Traceability Analysis of Olive Oils: Principles, Classifications and Applications
    “... and physical-chemical measured characteristics. The different chemometrics methods are illustrated by different...”
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    Article
  7. 187
    Structural and elastic properties of TiN and AlN compounds: first-principles study
    Subjects: “...first-principle calculations...”
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    Article
  8. 188
    A First-Principles Study on Na and O Adsorption Behaviors on Mo (110) Surface
    Subjects: “...first-principles calculation...”
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    Article
  9. 189
    Properties of Novel Non-Silicon Materials for Photovoltaic Applications: A First-Principle Insight
    “.... Based on this, we present a detailed first-principle investigation of the four optimal compounds, namely...”
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  10. 190
    First principles simulations : development of new density functionals and pseudopotentials and formation mechanism of fullerenes
    by Hua, Xinlei
    Published 1996
    “... state physics, while Chapter 4 develops the Ab initio version used mostly in chemistry. Part II also...”
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  11. 191
    Ground and Electronic Excited States from Pairing Matrix Fluctuation and Particle-Particle Random Phase Approximation
    by Yang, Yang
    Published 2016
    Subjects: “...Physical chemistry...”
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  12. 192
    Nanostructure-directed chemical sensing: The IHSAB principle and the dynamics of acid/base-interface interaction
    by James L. Gole, William Laminack
    Published 2013-01-01
    “... sensing with nanostructured materials. We couple the tenets of acid/base chemistry with the majority...”
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    Article
  13. 193
    Understanding the Principles of Pattern Formation Driven by Notch Signaling by Integrating Experiments and Theoretical Models
    “... models that help understand the operating principles of cell patterning driven by Notch signaling. First...”
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    Article
  14. 194
    OCS photolytic isotope effects from first principles: sulfur and carbon isotopes, temperature dependence and implications for the stratosphere
    “...Atmospheric Chemistry and Physics...”
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    Article
  15. 195
    Nuclear magnetic resonance data processing methods
    by Jones, Jonathan A.
    Published 1992
    Subjects: “...NMR spectroscopy : Physical & theoretical chemistry : Numerical analysis : Nuclear Magnetic...”
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  16. 196
    Nanomechanical properties of nanocomposite polymer layer
    by Tokarski, Tomasz
    Published 2019
    Subjects: “...Physical Chemistry...”
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  17. 197
    Electric Fields for Surface Design and Chemical Analysis
    by Ulrich, Christian
    Published 2008
    Subjects: “...Physical chemistry...”
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    Doctoral Thesis
  18. 198
    Electronic spectroscopy, kinetics and photodissociation dynamics of gas phase cations
    by Stringer, Kay Lesley
    Published 2004
    Subjects: “...Chemistry|Analytical chemistry...”
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  19. 199
    Impact of Polypyrrole Functionalization on the Anodic Performance of Boron Nitride Nanosheets: Insights From First-Principles Calculations
    “...Frontiers in Chemistry...”
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    Article
  20. 200
    I. Molecular simulations of buckyball fullerenes. II. Quantum chemistry studies on high-T_c superconductors.
    by Guo, Yuejin
    Published 1992
    “...Part I. In order to interpret and predict the unusual chemical and physical properties of the C_(60...”
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