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Organic Spintronics: A Theoretical Investigation of a Graphene-Porphyrin Based Nanodevice.
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- Magnetochemistry, 2020, v. 6, n. 2, p. 1, doi. 10.3390/magnetochemistry6020027
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The (E , Z) Isomerization of C -methoxycarbonyl- N -aryl Chlorohydrazones.
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- Chemistry (2624-8549), 2022, v. 4, n. 4, p. 1624, doi. 10.3390/chemistry4040106
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Interstitial Zn Atoms Do the Trick in Thermoelectric Zinc Antimonide, Zn4Sb3: A Combined Maximum Entropy Method X-ray Electron Density and Ab Initio Electronic Structure Study.
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- Chemistry - A European Journal, 2004, v. 10, n. 16, p. 3861, doi. 10.1002/chem.200400327
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- Article
Acetone and Toluene Gas Sensing by WO 3 : Focusing on the Selectivity from First Principle Calculations.
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- Nanomaterials (2079-4991), 2022, v. 12, n. 15, p. 2696, doi. 10.3390/nano12152696
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Magnetic Moments and Electron Transport through Chromium-Based Antiferromagnetic Nanojunctions.
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- Materials (1996-1944), 2018, v. 11, n. 10, p. 2030, doi. 10.3390/ma11102030
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- Article
Electronic Structure and Magnetic Coupling of Pure and Mg-Doped KCuF<sub>3</sub>.
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- Advances in Condensed Matter Physics, 2018, p. 1, doi. 10.1155/2018/9164270
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- Article
New Insight into the Electronic and Magnetic Properties of Sub-Stoichiometric WO 3 : A Theoretical Perspective.
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- Crystals (2073-4352), 2024, v. 14, n. 4, p. 372, doi. 10.3390/cryst14040372
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Chemical insight into electron density and wave functions: software developments and applications to crystals, molecular complexes and materials science.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2007, v. 117, n. 5/6, p. 847, doi. 10.1007/s00214-006-0208-z
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Direct-space analysis of the electronic structure of the YBa[sub 2] Cu[sub 3] O[sub 6] and YBa[sub 2] Cu[sub 3] O[sub 7] crystals.
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- Canadian Journal of Chemistry, 2002, v. 80, n. 3, p. 235, doi. 10.1139/v02-014
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Chemical information from the source function.
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- Journal of Computational Chemistry, 2003, v. 24, n. 4, p. 422, doi. 10.1002/jcc.10205
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- Article
Thermodynamic Stability and Electronic Properties of Graphene Nanoflakes.
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- C, 2024, v. 10, n. 1, p. 5, doi. 10.3390/c10010005
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- Article
Ammonium Ferrate‐Catalyzed Cycloaddition of CO<sub>2</sub> to Aziridines for the Synthesis of 1,3‐Oxazolidin‐2‐ones.
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- European Journal of Organic Chemistry, 2022, v. 2022, n. 40, p. 1, doi. 10.1002/ejoc.202200908
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- Article