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1. Full Text Ab initio calculation of energy levels of trivalent lanthanide ions
by Freidzon, Alexandra Ya and Kurbatov, Ilia A and Vovna, Vitaliy I
Physical chemistry chemical physics : PCCP, ISSN 1463-9076, 2018, Volume 20, Issue 21, pp. 14564 - 14577
Physical Sciences | Chemistry | Physics, Atomic, Molecular & Chemical | Chemistry, Physical | Physics | Science & Technology | Perturbation theory | Energy levels | Aluminum | Group theory | Cerium | Parameterization | Empirical analysis | Yttrium-aluminum garnet | Accuracy | Energy gap | Emission spectra | Ligands | Field theory | Yttrium
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2. Full Text Rotating magnetic particles for lab-on-chip applications-a comprehensive review
by Moerland, C.P and van IJzendoorn, L.J and Prins, M.W.J
Lab on a chip, ISSN 1473-0197, 03/2019, Volume 19, Issue 6, pp. 919 - 933
Models, Theoretical | Bioengineering | Biomarkers/analysis | Biosensing Techniques/methods | Humans | Magnetite Nanoparticles/chemistry | Chemistry(all) | Lab-On-A-Chip Devices | Biochemistry | Review | Magnetics | Journal Article | Biomedical Engineering | Biochemistry & Molecular Biology | Physical Sciences | Chemistry | Nanoscience & Nanotechnology | Life Sciences & Biomedicine | Biochemical Research Methods | Science & Technology - Other Topics | Chemistry, Analytical | Chemistry, Multidisciplinary | Science & Technology | Rotating fluids | Torque | Molecular structure | Actuation | Biomolecules | Lab-on-a-chip | Angular velocity | Magnetic fields | Rotation | Structural analysis
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3. Full Text The σ-hole revisited
by Politzer, Peter and Murray, Jane S and Clark, Timothy and Resnati, Giuseppe
Physical chemistry chemical physics : PCCP, ISSN 1463-9076, 12/2017, Volume 19, Issue 48, pp. 32166 - 32178
Chemical bonds | Density | Angular position
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4. Full Text Ultrafast imaging of laser-controlled non-adiabatic dynamics in NO2 from time-resolved photoelectron emission
by Richter, Maria and González-Vázquez, Jesús and Mašín, Zden k and Brambila, Danilo S and Harvey, Alex G and Morales, Felipe and Martín, Fernando
Physical chemistry chemical physics : PCCP, ISSN 1463-9076, 5/2019, Volume 21, Issue 19, pp. 138 - 151
Physical Sciences | Chemistry | Physics, Atomic, Molecular & Chemical | Chemistry, Physical | Physics | Science & Technology
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5. Full Text Spectroscopy of YO from first principles
by Smirnov, Alexander N and Solomonik, Victor G and Yurchenko, Sergei N and Tennyson, Jonathan
Physical chemistry chemical physics : PCCP, ISSN 1463-9076, 11/2019, Volume 21, Issue 41, pp. 22794 - 22810
Physical Sciences | Chemistry | Physics, Atomic, Molecular & Chemical | Chemistry, Physical | Physics | Science & Technology | Index Medicus
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6. Full Text Bayesian machine learning for quantum molecular dynamics
by Krems, R. V
Physical chemistry chemical physics : PCCP, ISSN 1463-9076, 6/2019, Volume 21, Issue 25, pp. 13392 - 1341
Physical Sciences | Chemistry | Physics, Atomic, Molecular & Chemical | Chemistry, Physical | Physics | Science & Technology | Potential energy | Numerical integration | Parameters | Computer simulation | Energy distribution | Molecular dynamics | Physical properties | Collision dynamics | Couplings | Interpolation | Machine learning | Angular momentum | Mathematical models | Schroedinger equation | Conditioning | Bayesian analysis | Artificial intelligence | Quantum theory
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