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Modern Physics Letters A, ISSN 0217-7323, 06/2015, Volume 30, Issue 20, p. 1550097
Within the framework of relativistic Thomas–Fermi (RTF) and relativistic extended Thomas–Fermi (RETF) approximations, we calculate the giant monopole resonance... 
Relativistic mean field theory | collective excitation | Thomas-Fermi and extended Thomas-Fermi | MATTER | FINITE-NUCLEI | ASTRONOMY & ASTROPHYSICS | PHYSICS, NUCLEAR | PHYSICS, MATHEMATICAL | PHYSICS, PARTICLES & FIELDS
Journal Article
Applied Surface Science, ISSN 0169-4332, 10/2018, Volume 456, pp. 351 - 359
Sensitivity of Fe-decorated graphene with three different graphene-based supports (single vacancy, double vacancy and four nitrogen decorated) toward toxic gas... 
Fe-decorated graphene | Adsorption characteristics | Steric effect | Fermi softness | PHYSICS, CONDENSED MATTER | PHYSICS, APPLIED | CARBON | EMISSIONS | CHEMISTRY, PHYSICAL | N2O | AIR | THERMAL-CONDUCTIVITY | SO2 | CATALYTIC-OXIDATION | WO3 | EMBEDDED GRAPHENE | MATERIALS SCIENCE, COATINGS & FILMS | Density functionals | Sensors | Adsorption | Graphene | Specific gravity | Graphite
Journal Article
Applied Surface Science, ISSN 0169-4332, 07/2019, Volume 481, pp. 940 - 950
Density functional theory calculations were used to study the adsorption of NO on Ni cluster (  = 1, 2, 3 and 4) doped graphene with different graphene-based... 
Density functional theory | Adsorption energy | Nin cluster | Fermi softness | Graphene-based support
Journal Article
Angewandte Chemie International Edition, ISSN 1433-7851, 05/2016, Volume 55, Issue 21, pp. 6239 - 6243
Journal Article
Applied Surface Science, ISSN 0169-4332, 04/2018, Volume 436, pp. 585 - 595
Journal Article
Applied Surface Science, ISSN 0169-4332, 07/2019, Volume 481, pp. 940 - 950
Density functional theory calculations were used to study the adsorption of NO on Ni cluster (n = 1, 2, 3 and 4) doped graphene with different graphene-based... 
cluster | Density functional theory | Adsorption energy | Fermi softness | Graphene-based support | PHYSICS, CONDENSED MATTER | ACTIVATION | PHYSICS, APPLIED | SINGLE-ATOM | OXIDE | EMISSIONS | Ni-n cluster | REACTIVITY | CHEMISTRY, PHYSICAL | CO OXIDATION | NANOCLUSTERS | DFT | SURFACE | CATALYSTS | MATERIALS SCIENCE, COATINGS & FILMS
Journal Article
Computational Materials Science, ISSN 0927-0256, 10/2018, Volume 153, pp. 217 - 227
The design of α-MoO /γ-Al O composite is of high interest because such composites are with extraordinary catalytic selectivity for petroleum refining. However,... 
α-MoO3 | DFT | Surface reactivity | γ-Al2O3 | Interfacial stability | Fermi softness | γ-Al | α-MoO
Journal Article
by Yu, MY and Qu, WW and Xu, SM and Wang, L and Liu, BG and Zhang, LB and Peng, JH
COMPUTATIONAL MATERIALS SCIENCE, ISSN 0927-0256, 10/2018, Volume 153, pp. 217 - 227
The design of alpha-MoO3/gamma-Al2O3 composite is of high interest because such composites are with extraordinary catalytic selectivity for petroleum refining.... 
gamma-Al2O3 | SELECTIVE OXIDATION | MOO3 | Surface reactivity | MATERIALS SCIENCE, MULTIDISCIPLINARY | Fermi softness | GAMMA-ALUMINA | GENERALIZED GRADIENT APPROXIMATION | SUPPORT | DFT | HYDRODEOXYGENATION | Interfacial stability | MOLYBDENUM OXIDE CATALYSTS | alpha-MoO3 | GAS-PHASE | OXIDATIVE DEHYDROGENATION | DENSITY-FUNCTIONAL THEORY
Journal Article
Journal of Inclusion Phenomena and Macrocyclic Chemistry, ISSN 1388-3127, 12/2016, Volume 86, Issue 3, pp. 359 - 373
The aims of this work, to study the electronic and adsorption properties of the interaction hydrogen cyanide with the pristine and B, Ga, BGa-doped (8, 0)... 
Crystallography and Scattering Methods | Hydrogen cyanide | Chemistry | Food Science | DFT | Interaction | MEP | AlPNTs | NBO | Organic Chemistry | OXIDATION | PHOSPHIDE NANOTUBES | MOLECULAR-STRUCTURE | EMISSIONS | ADSORPTION | CHEMISTRY, MULTIDISCIPLINARY | CARBON NANOTUBES | HCN | ACTIVATED CARBONS | CHEMISTRY | DENSITY-FUNCTIONAL THEORY
Journal Article
International Journal of Astrobiology, ISSN 1473-5504, 10/2017, Volume 16, Issue 4, pp. 349 - 354
The Zoo solution to Fermi's Paradox proposes that extraterrestrial intelligences (ETIs) have agreed to not contact the Earth. The strength of this solution... 
Fermi's Paradox | SETI | Zoo Hypothesis | simulation | GEOSCIENCES, MULTIDISCIPLINARY | ASTRONOMY & ASTROPHYSICS | BIOLOGY | HABITABLE ZONE | LIFE | AGE | Interstellar | Galaxies | Astrobiology | Hegemony | Police | Earth | Civilization | Hypotheses | Treaties | Spacetime | Astronomical models | Softness | Extraterrestrial intelligence | Extraterrestrial material | Agreements | Star & galaxy formation | Physics - Popular Physics
Journal Article
Angewandte Chemie, ISSN 0044-8249, 05/2016, Volume 128, Issue 21, pp. 6347 - 6351
A new property is reported that accurately quantifies and spatially describes the chemical reactivity of solid surfaces. The core idea is to create a... 
Fermi-Weichheit | Zustandsdichte | Heterogene Katalyse | Oberflächenreaktivität | Dichtefunktionalrechnungen | Heterogeneous catalysis | Anisotropy | Analysis | Solid surfaces | Catalysts | Weight function | Surface chemistry | Softness | Catalysis | Design analysis
Journal Article
PHYSICAL REVIEW B, ISSN 1098-0121, 12/2000, Volume 62, Issue 23, pp. 15561 - 15568
Formation of an insulating ground stare in the salt of kappa-(BEDT-TTF)(2)Cu[N(CN)(2)]I was studied by measuring the temperature dependence of the electronic... 
TRANSITION | PHYSICS, CONDENSED MATTER | ORGANIC SUPERCONDUCTOR KAPPA-(BEDT-TTF)CUBR | LATTICE SOFTNESS | PHASE | FERMI-SURFACE | THERMAL-EXPANSION | BEDT-TTF | X = CL | SALTS
Journal Article
Acta Materialia, ISSN 1359-6454, 02/2012, Volume 60, Issue 4, pp. 1594 - 1602
Journal Article
Applied Surface Science, ISSN 0169-4332, 07/2019, Volume 483, pp. 231 - 240
Journal Article
Protection of Metals and Physical Chemistry of Surfaces, ISSN 2070-2051, 1/2011, Volume 47, Issue 1, pp. 1 - 7
Journal Article
Physical Review D (Particles, Fields, Gravitation and Cosmology), ISSN 1550-7998, 03/2012, Volume 85, Issue 6
The cross section of elastic electron-proton scattering taking place in an electron gas is calculated within the closed time path method by means of the... 
Fermi surfaces | Rendering | Asymptotic properties | Mathematical analysis | Scattering | Elastic scattering | Cosmology | Cross sections
Journal Article
AIP Conference Proceedings, ISSN 0094-243X, 03/2009, Volume 1099, Issue 1
The Os nuclei lie in the beginning of the transitional region between the well deformed rare earth and spherical lead isotopes. The nuclei in this region are... 
EXCITATION | CORRELATIONS | KEV RANGE | COMPARATIVE EVALUATIONS | GAMMA DETECTION | ROTATIONAL STATES | NUCLEAR POTENTIAL | HARTREE-FOCK METHOD | NUCLEAR PHYSICS AND RADIATION PHYSICS | HOLMIUM 165 TARGET | MULTIPOLARITY | NEON 20 REACTIONS | OSMIUM 178 | HIGH-PURITY GE DETECTORS | NUCLEAR STRUCTURE | POLARIZATION | GROUND STATES | FERMI LEVEL
Journal Article
Computational and Theoretical Chemistry, ISSN 2210-271X, 02/2015, Volume 1053, pp. 44 - 52
The charge density response function and the exchange hole are closely related to each other via the fundamental fluctuation–dissipation theorem of physics. A... 
Topological analysis | Charge density response function | Electron localization | Fermi-hole | Localized orbitals | ADIABATIC CONNECTION | LINEAR-RESPONSE | CONCEPTUAL DFT | CHEMISTRY, PHYSICAL | TOPOLOGICAL THEORY | SCATTERING FUNCTIONS | DISTRIBUTED POLARIZABILITIES | COVALENT BOND ORDERS | CHEMICAL-BONDS | Physics - Chemical Physics
Journal Article