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Borospherene
Borospherene (B40) is an electron-deficient cluster molecule containing 40 boron atoms. It bears similarities to other homoatomic cluster structures such as buckminsterfullerene (C60), stannaspherene, and plumbaspherene, but with a different symmetry. The first experimental evidence for borospherene was reported in July 2014, and is described in the journal ''Nature Chemistry''. The molecule includes unusual hexagonal and heptagonal faces. Despite many calculation-based investigations into its structure and properties, a viable route for the synthesis and isolation of borospherene has yet to be established, and as a consequence it is still relatively poorly understood. History In 2014, the first experimental evidence of a homoelemental fullerene-like B40 cluster was reported by Zhai ''et al''., after decades of theoretical investigations into boron cage structures following the discovery of buckminsterfullerene. Anionic B40− clusters were transiently produced by laser vaporis ...
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Fullerene
A fullerene is an allotropes of carbon, allotrope of carbon whose molecules consist of carbon atoms connected by single and double bonds so as to form a closed or partially closed mesh, with fused rings of five to six atoms. The molecules may have hollow sphere- and ellipsoid-like forms, cylinder (geometry), tubes, or other shapes. Fullerenes with a closed mesh topology are informally denoted by their empirical formula C''n'', often written C''n'', where ''n'' is the number of carbon atoms. However, for some values of ''n'' there may be more than one isomer. The family is named after buckminsterfullerene (C60), the most famous member, which in turn is named after Buckminster Fuller. The closed fullerenes, especially C60, are also informally called buckyballs for their resemblance to the standard ball (association football), ball of association football. Nested closed fullerenes have been named bucky onions. Cylindrical fullerenes are also called carbon nanotubes or buckytubes ...
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B40 HOMO View 1 (heptagon Face)
B4, B04, B.IV or B-4 may refer to: Transportation Aviation * B4, IATA code of Beond, an airline based in Malé, Maldives * B4, IATA code of B.A.C.H. Flugbetrieb, an Austrian charter airline (ICAO code BCF) * B4, IATA code of Bankair, an US American charter airline (ICAO code BKA) * B4, then-IATA code of Flyglobespan, a former British airline * Auster B.4, 1951 British light transport aircraft with rear ramp * Bensen B-4, Bensen Aircraft autogyro * Bäumer B IV Sausewind, German 1920s sports aircraft * Fokker B.IV, parent company's designation for American branch's F.11 seaplane * Hawker B 4, Swedish designation for Hawker Hart biplane * Keystone B-4, United States biplane bomber * Lohner B.IV, an Austro-Hungarian World War 1 reconnaissance biplane * Pilatus B-4, Swiss glider also designated PC-11. Locomotives * Alsace-Lorraine B 4, an Alsace-Lorraine P 1 class steam locomotive * Bavarian B IV, an 1852 German steam locomotive * GSR Class B4, a former Cork, Bandon and ...
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Carbon Disulfide
Carbon disulfide (also spelled as carbon disulphide) is an inorganic compound with the chemical formula and structure . It is also considered as the anhydride of thiocarbonic acid. It is a colorless, flammable, neurotoxic liquid that is used as a building block in organic synthesis. Pure carbon disulfide has a pleasant, ether- or chloroform-like odor, but commercial samples are usually yellowish and are typically contaminated with foul-smelling impurities.. History In 1796, the German chemist Wilhelm August Lampadius (1772–1842) first prepared carbon disulfide by heating pyrite with moist charcoal. He called it "liquid sulfur" (''flüssig Schwefel''). The composition of carbon disulfide was finally determined in 1813 by the team of the Swedish chemist Jöns Jacob Berzelius (1779–1848) and the Swiss-British chemist Alexander Marcet (1770–1822). Their analysis was consistent with an empirical formula of CS2. Occurrence, manufacture, properties Small amounts of carbon ...
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Sulfur Dioxide
Sulfur dioxide (IUPAC-recommended spelling) or sulphur dioxide (traditional Commonwealth English) is the chemical compound with the formula . It is a colorless gas with a pungent smell that is responsible for the odor of burnt matches. It is released naturally by volcanic activity and is produced as a by-product of metals refining and the burning of Sour gas, sulfur-Sour crude oil, bearing fossil fuels. Sulfur dioxide is somewhat toxic to humans, although only when inhaled in relatively large quantities for a period of several minutes or more. It was known to medieval alchemy, alchemists as "volatile spirit of sulfur". Structure and bonding SO2 is a bent molecule with ''C''2v Point groups in three dimensions, symmetry point group. A valence bond theory approach considering just ''s'' and ''p'' orbitals would describe the bonding in terms of resonance (chemistry), resonance between two resonance structures. The sulfur–oxygen bond has a bond order of 1.5. There is support f ...
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Sulfur
Sulfur ( American spelling and the preferred IUPAC name) or sulphur ( Commonwealth spelling) is a chemical element; it has symbol S and atomic number 16. It is abundant, multivalent and nonmetallic. Under normal conditions, sulfur atoms form cyclic octatomic molecules with the chemical formula S8. Elemental sulfur is a bright yellow, crystalline solid at room temperature. Sulfur is the tenth most abundant element by mass in the universe and the fifth most common on Earth. Though sometimes found in pure, native form, sulfur on Earth usually occurs as sulfide and sulfate minerals. Being abundant in native form, sulfur was known in ancient times, being mentioned for its uses in ancient India, ancient Greece, China, and ancient Egypt. Historically and in literature sulfur is also called brimstone, which means "burning stone". Almost all elemental sulfur is produced as a byproduct of removing sulfur-containing contaminants from natural gas and petroleum.. Downloahere Th ...
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Time-dependent Density Functional Theory
Time-dependent density-functional theory (TDDFT) is a quantum mechanical theory used in physics and chemistry to investigate the properties and dynamics of many-body systems in the presence of time-dependent potentials, such as electric or magnetic fields. The effect of such fields on molecules and solids can be studied with TDDFT to extract features like excitation energies, frequency-dependent response properties, and photoabsorption spectra. TDDFT is an extension of density-functional theory (DFT), and the conceptual and computational foundations are analogous – to show that the (time-dependent) wave function is equivalent to the (time-dependent) electronic density, and then to derive the effective potential of a fictitious non-interacting system which returns the same density as any given interacting system. The issue of constructing such a system is more complex for TDDFT, most notably because the time-dependent effective potential at any given instant depends on t ...
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Redshift
In physics, a redshift is an increase in the wavelength, and corresponding decrease in the frequency and photon energy, of electromagnetic radiation (such as light). The opposite change, a decrease in wavelength and increase in frequency and energy, is known as a #Blueshift, blueshift. The terms derive from the colours red and blue which form the extremes of the Visible spectrum, visible light spectrum. Three forms of redshift occur in astronomy and cosmology: Doppler effect, Doppler redshifts due to the relative motions of radiation sources, gravitational redshift as radiation escapes from gravitational potentials, and cosmological redshifts of all light sources proportional to their distances from Earth, a fact known as Hubble's law that implies the expansion of the universe, universe is expanding. All redshifts can be understood under the umbrella of Frame of reference, frame transformation laws. Gravitational waves, which also travel at Speed of light, the speed of light, a ...
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Density Functional Theory
Density functional theory (DFT) is a computational quantum mechanical modelling method used in physics, chemistry and materials science to investigate the electronic structure (or nuclear structure) (principally the ground state) of many-body systems, in particular atoms, molecules, and the condensed phases. Using this theory, the properties of a many-electron system can be determined by using functionals - that is, functions that accept a function as input and output a single real number. In the case of DFT, these are functionals of the spatially dependent electron density. DFT is among the most popular and versatile methods available in condensed-matter physics, computational physics, and computational chemistry. DFT has been very popular for calculations in solid-state physics since the 1970s. However, DFT was not considered accurate enough for calculations in quantum chemistry until the 1990s, when the approximations used in the theory were greatly refined to better m ...
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Van Der Waals Force
In molecular physics and chemistry, the van der Waals force (sometimes van der Waals' force) is a distance-dependent interaction between atoms or molecules. Unlike ionic or covalent bonds, these attractions do not result from a chemical electronic bond; they are comparatively weak and therefore more susceptible to disturbance. The van der Waals force quickly vanishes at longer distances between interacting molecules. Named after Dutch physicist Johannes Diderik van der Waals, the van der Waals force plays a fundamental role in fields as diverse as supramolecular chemistry, structural biology, polymer science, nanotechnology, surface science, and condensed matter physics. It also underlies many properties of organic compounds and molecular solids, including their solubility in polar and non-polar media. If no other force is present, the distance between atoms at which the force becomes repulsive rather than attractive as the atoms approach one another is called the van der ...
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Exohedral Fullerene
Exohedral fullerenes, also called exofullerenes, are fullerenes that have additional atoms, ions, or clusters attached their outer spheres, such as C50Cl10 and C60H8. or fullerene ligands. See also *Endohedral fullerene Endohedral fullerenes, also called endofullerenes, are fullerenes that have additional atoms, ions, or clusters enclosed within their inner spheres. The first lanthanum C60 complex called La@C60 was synthesized in 1985. The @ (at sign) in t ... References {{reflist, 2 Fullerenes Supramolecular chemistry ...
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Endohedral Fullerene
Endohedral fullerenes, also called endofullerenes, are fullerenes that have additional atoms, ions, or clusters enclosed within their inner spheres. The first lanthanum C60 complex called La@C60 was synthesized in 1985. The @ (at sign) in the name reflects the notion of a small molecule trapped inside a shell. Two types of endohedral complexes exist: endohedral metallofullerenes and non-metal doped fullerenes. Notation In a traditional chemical formula notation, a buckminsterfullerene (C60) with an atom (M) was simply represented as MC60 regardless of whether M was inside or outside the fullerene. In order to allow for more detailed discussions with minimal loss of information, a more explicit notation was proposed in 1991, where the atoms listed to the left of the @ sign are situated inside the network composed of the atoms listed to the right. The example above would then be denoted M@C60 if M were inside the carbon network. A more complex example is K2(K@C59B), which de ...
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