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|a Modelling of molecular properties :
|b theoretical principles and numerical simulations /
|c edited by Maria Emilova Velinova.
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|a Ashland :
|b Arcler Press,
|c 2019.
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| 300 |
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|a 1 online resource (337 pages)
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|b EBSCO eBook Subscription Academic Collection - Worldwide
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|a Quantum theory.
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| 650 |
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2 |
|a Quantum Theory
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| 650 |
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6 |
|a Théorie quantique.
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| 650 |
|
7 |
|a Quantum theory.
|2 fast
|0 (OCoLC)fst01085128
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|a Velinova, Maria Emilova,
|e editor.
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|i Print version:
|a Velinova, Maria Emilova.
|t Modelling of Molecular Properties : Theoretical Principles and Numerical Simulations.
|d Ashland : Arcler Press, ©2019
|
| 856 |
4 |
0 |
|u https://ebsco.uam.elogim.com/login.aspx?direct=true&scope=site&db=nlebk&AN=2013954
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|6 505-00/(S
|g Section I.
|t Elements of Quantum Mechanics : --
|g 1.
|t Recovering the Quantum Formalism from Physically Realist Axioms --
|g 2.
|t Intuitive Concept or Physical Meaning of Lagrangian --
|g 3.
|t The Variational Method In Quantum Mechanics: An Elementary Introduction --
|g Section II.
|t Electromagnetic Fields And Symmetry : --
|g 4.
|t Electromagnetic Potentials Basis For Energy Density And Power Flux --
|g 5.
|t "First-Principles Theory of Magnetic Multipoles In Condensed Matter Systems" --
|g 6.
|t Quantum Transport Enhancement by Time-Reversal Symmetry Breaking --
|g Section III.
|t State Response Theory And Molecular Properties : --
|g 7.
|t Current-Constrained Density-Matrix Theory To Calculate Molecular Conductivity With Increased --
|g 8.
|t Static and Lattice Vibrational Energy Differences Between Polymorphs --
|g 9.
|t Conformational Analysis, Inter-Molecular Interactions, Electronic Properties And Vibrational Spectroscopic Studies on CIS-4-Hydroxy-D-Proline --
|g Section IV.
|t Response Functions And Spectroscopies : --
|g 10.
|t Energies, Fine Structures, and Hyperfine Structures of the 1S²2SNP³P (N = 2-4) States For The Beryllium Atom --
|g 11.
|t Theoretical Study On The Static (Hyper Polarizabilities of α-T-Bu-ω-CN-Poly(Methylphenyl)Silane --
|g 12.
|t Magnetic Properties With Multiwavelets and DFT: The Complete Basis Set Limit Achieved.
|
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