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1
المؤلفون: Klaus Doll, M. Neef
المصدر: Surface Science. 600:1085-1092
مصطلحات موضوعية: Ab initio, Surfaces and Interfaces, Condensed Matter Physics, Molecular physics, Surfaces, Coatings and Films, Hybrid functional, chemistry.chemical_compound, Adsorption, chemistry, Chemisorption, Materials Chemistry, Density functional theory, Atomic physics, Local-density approximation, HOMO/LUMO, Carbon monoxide
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_________::9d6a145ef48008a38b6211f2ebafe192Test
https://doi.org/10.1016/j.susc.2005.12.036Test -
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المؤلفون: Klaus Doll
المصدر: Surface Science. 573:464-473
مصطلحات موضوعية: Condensed Matter - Materials Science, education.field_of_study, Chemistry, Population, Materials Science (cond-mat.mtrl-sci), FOS: Physical sciences, chemistry.chemical_element, Thermodynamics, Surfaces and Interfaces, Condensed Matter Physics, Surfaces, Coatings and Films, Hybrid functional, Adsorption, Transition metal, Computational chemistry, Materials Chemistry, Density of states, Cluster (physics), Platinum, education, HOMO/LUMO
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::3cfd556a41150ecf85f34716dbf6e5a9Test
https://doi.org/10.1016/j.susc.2004.10.015Test -
3
المؤلفون: C. Richard A. Catlow, Iman Saadoune, Furio Corà, Klaus Doll
المصدر: Molecular Simulation. 30:607-615
مصطلحات موضوعية: chemistry.chemical_classification, Water dimer, Base (chemistry), Dopant, General Chemical Engineering, Inorganic chemistry, Ab initio, General Chemistry, Condensed Matter Physics, Catalysis, Adsorption, chemistry, Modeling and Simulation, Physical chemistry, General Materials Science, Lewis acids and bases, Brønsted–Lowry acid–base theory, Information Systems
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_________::089637b33f33107647b6f4ec66afa757Test
https://doi.org/10.1080/08927020410001717227Test -
4
المؤلفون: Klaus Doll
المصدر: Surface Science. 544:103-120
مصطلحات موضوعية: Magnetic moment, chemistry.chemical_element, Charge density, Surfaces and Interfaces, Electronic structure, Condensed Matter Physics, Surface energy, Surfaces, Coatings and Films, Condensed Matter::Materials Science, Nickel, Adsorption, Atomic orbital, chemistry, Transition metal, Chemical physics, Materials Chemistry, Physical chemistry, Physics::Chemical Physics
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_________::f9acb6c3843e72070e73aebece5f256aTest
https://doi.org/10.1016/j.susc.2003.07.008Test -
5
المؤلفون: Klaus Doll
المصدر: The European Physical Journal B. 22:389-393
مصطلحات موضوعية: Condensed Matter - Materials Science, education.field_of_study, Materials science, Population, Materials Science (cond-mat.mtrl-sci), FOS: Physical sciences, chemistry.chemical_element, Condensed Matter Physics, Copper, Electronic, Optical and Magnetic Materials, Bond length, Crystallography, Adsorption, chemistry, Covalent bond, Density of states, Local-density approximation, education, Metallic bonding
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::7ee88d4ce62266b285a96f855901c5daTest
https://doi.org/10.1007/s100510170118Test -
6
المؤلفون: Piero Ugliengo, Klaus Doll, Sergio Tosoni
المساهمون: Tosoni, S, Doll, K, Ugliengo, P
المصدر: ChemInform. 37
مصطلحات موضوعية: Surface (mathematics), Materials science, ADSORPTION, General Chemical Engineering, INITIO HARTREE-FOCK, Molecular physics, Quality (physics), CHEMISTRY, Computational chemistry, Materials Chemistry, Kaolinite, SILICA, EXCHANGE, Basis set, AB-INITIO, Hydrogen bond, Chemistry, SURFACES, HYDROXYL, Anharmonicity, General Chemistry, General Medicine, Amplitude, DENSITY, Potential energy surface, BIOCHEMICAL EVOLUTION
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::1e6cc1a99115f82fdfcdfc232b22c3c0Test
https://doi.org/10.1002/chin.200627002Test -
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المؤلفون: Klaus Doll
مصطلحات موضوعية: Physics, Surface (mathematics), Bond length, Crystallography, Condensed Matter - Materials Science, Adsorption, Degenerate energy levels, Atom, Physical chemistry, Materials Science (cond-mat.mtrl-sci), FOS: Physical sciences, Charge (physics), Substrate (electronics)
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::5d78f6ac93ddbc966f6801e6f1762d86Test
http://arxiv.org/abs/cond-mat/0209028Test -
8
المؤلفون: Nicholas M. Harrison, Klaus Doll
مصطلحات موضوعية: Surface (mathematics), Condensed Matter - Materials Science, Materials science, Materials Science (cond-mat.mtrl-sci), FOS: Physical sciences, Ionic bonding, chemistry.chemical_element, Bond length, Adsorption, chemistry, Chemical physics, Covalent bond, Potential gradient, Chlorine, Physical chemistry, Local-density approximation, GeneralLiterature_REFERENCE(e.g.,dictionaries,encyclopedias,glossaries)
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::81ea15b9e146dfe62c9131a690cc8514Test
http://hdl.handle.net/10044/1/754Test -
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المؤلفون: Klaus Doll, Nicholas M. Harrison
مصطلحات موضوعية: Surface diffusion, Surface (mathematics), Condensed Matter - Materials Science, Materials science, Scattering, Analytical chemistry, Materials Science (cond-mat.mtrl-sci), FOS: Physical sciences, General Physics and Astronomy, Adsorption geometry, chemistry.chemical_element, Ion, Adsorption, chemistry, Electron diffraction, Chlorine, polycyclic compounds, Physical and Theoretical Chemistry
الوصول الحر: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::cd775b6ef9a78973a4d1e5abe84109ffTest
http://hdl.handle.net/10044/1/1196Test