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Orbital hydrogen

Flehre W J, Ditchfieid R and Popie J A 1972 Self-consistent molecular-orbital methods XII. Further extension of Gaussian-type basis sets for use in molecular orbital studies of organic molecules J. Chem. Phys. 56 2257-61 Flariharan P C and Popie J A 1973 The influence of polarization functions on molecular orbital hydrogenation energies Theoret. Chim. Acta. 28 213-22... [Pg.2195]

Hariharan, P.C. Pople, I.A. The influence of polarization functions on molecular orbital hydrogenation energies Theor. Chim. Acta. 28 213-222, 1973. [Pg.110]

Hariharan, P. C., Pople, J. A., 1973, The Influence of Polarization Functions on Molecular Orbital Hydrogenation Energies , Theor. Chim. Acta., 28, 213. [Pg.290]

Carbon orbitals Molecular orbitals Hydrogen group orbitals... [Pg.158]

Since hydrogen has one valence electron, its group number is 1 and since the electron is in the s orbital, hydrogen is in group A. Therefore, H is in the 1A group. At the same time, because the principal quantum number (valence shell) of the s orbital is 1, H is in the 1st period. So, hydrogen is the element of 1st period and group 1A. [Pg.38]

So far we have described only the lowest-energy wave function in the hydrogen atom, the Is orbital. Hydrogen has many other orbitals, which are described in the next section. [Pg.540]

Three locations that hydrogen may be found atop the periodic table Group 1 (due to Is configuration), Group 14 (due to half-filled orbital), and Group 17 (due to 1 electron shy of full orbital). Hydrogen is most commonly found atop Group 1 by convention. [Pg.162]

Iet us investigate the molecular orbitals of BeH2, a very simple linear triatomic molecule. As in a diatomic molecule, we tag the molecular axis the axis (the H-Be-H line), as shown in Fig. 3-1. Beryllium has 2j and Ip valence orbitals hydrogen has a Ij valence orbital. The molecular orbitals for BeHa are formed by using... [Pg.87]

So far we have described only the lowest-energy wave function in the hydrogen atom, the li orbital. Hydrogen has many other orbitals, which we will describe in the next section. However, before we proceed, we should summarize what we have said about the meaning of an atomic orbital. An orbital is difficult to define precisely at an introductory level. Technically, an orbital is a wave function. However, it is usually most helpful to picture an orbital as a three-dimensional electron density map. That is, an electron in a particular atomic orbital is assumed to exhibit the electron probability indicated by the orbital map. [Pg.313]

The use of Cartesian Gaussian-type orbitals (GTOs) in ab initio work may come as a surprise to anyone who recalls the functional form of the hydrogen atom orbitals, hydrogen exp( - Ir). Cartesian GTO s have the form ... [Pg.4]

Symmetry Boron atomic orbitals Hydrogen atomic orbitals Molecular orbitals... [Pg.190]

It is important to recognize that we do not use hybrid orbitals to predict molecular geometries, but rather to explain geometries that are already known. As we saw in Section 9.3, the bonding in many molecules can be explained without the use of hybrid orbitals. Hydrogen sulfide (H2S), for example, has a bond angle of 92°. This bond angle is best explained without the use of hybrid orbitals. [Pg.332]

Polarization Functions on Molecular Orbital Hydrogenation Energies. [Pg.157]

Atomic orbits hydrogen atom quantum numbers... [Pg.461]


See other pages where Orbital hydrogen is mentioned: [Pg.387]    [Pg.283]    [Pg.313]    [Pg.15]    [Pg.69]    [Pg.33]    [Pg.1672]    [Pg.283]    [Pg.65]    [Pg.250]    [Pg.405]    [Pg.420]    [Pg.267]    [Pg.1671]    [Pg.181]    [Pg.300]    [Pg.225]    [Pg.170]   


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A Molecular Orbital Model of the Hydrogen Bond

Atomic orbitals hydrogen atom

Atomic orbitals of hydrogen

Atomic orbits hydrogen atom quantum numbers

Atomic theory hydrogen orbitals

Energy levels of hydrogenic orbitals summary

Hydrogen 2s orbital

Hydrogen Is orbital

Hydrogen abstraction natural orbital correlation diagram

Hydrogen atom atomic orbital representations

Hydrogen atom molecular orbital theory

Hydrogen atom orbital diagram

Hydrogen atom orbital energy

Hydrogen atom orbital energy-level diagrams

Hydrogen atom orbital normalization

Hydrogen atom orbital overlap

Hydrogen atom orbital shapes

Hydrogen atom orbitals

Hydrogen atom s orbitals

Hydrogen atom using Slater orbitals

Hydrogen atom, atomic orbital

Hydrogen atom, atomic orbital orbitals

Hydrogen atomic orbital

Hydrogen atomic orbitals

Hydrogen bond molecular orbital

Hydrogen bonding antibonding orbitals

Hydrogen bonding from molecular orbitals

Hydrogen bonding molecular orbitals

Hydrogen bonding orbitals

Hydrogen bonding, semiempirical molecular orbital theory

Hydrogen bonds semiempirical molecular orbital

Hydrogen chloride, molecular orbitals

Hydrogen continued orbital levels

Hydrogen cyanide bonding molecular orbitals

Hydrogen fluoride molecular orbitals

Hydrogen fluoride orbital energies

Hydrogen fluoride orbital overlap

Hydrogen frontier molecular orbitals

Hydrogen group orbitals

Hydrogen hybrid orbitals

Hydrogen hydrogenlike atomic orbitals

Hydrogen molecular orbital

Hydrogen molecular orbital scheme

Hydrogen molecular orbital theory

Hydrogen molecule antibonding orbital

Hydrogen molecule molecular orbital

Hydrogen molecule orbital energies

Hydrogen molecule spin orbitals

Hydrogen molecule, bond length molecular orbitals

Hydrogen molecule, bond orbitals

Hydrogen molecule, molecular orbitals

Hydrogen molecule, orbitals

Hydrogen orbital diagram

Hydrogen orbital energies

Hydrogen orbital interaction diagrams

Hydrogen orbital overlap

Hydrogen orbitals

Hydrogen orbitals

Hydrogen orbitals and

Hydrogen orbitals angular functions

Hydrogen orbitals decomposition

Hydrogen orbitals interpretation

Hydrogen orbitals radial functions

Hydrogen orbitals representations

Hydrogen orbitals used

Hydrogen s orbitals

Hydrogen, molecular orbital structure

Hydrogen-like atom atomic orbitals

Hydrogen-like atom spin-orbit coupling

Hydrogen-like orbitals

Hydrogen-like orbitals computation

Hydrogen-like orbitals radial distribution function

Hydrogen-like orbitals regions

Hydrogen-like species, orbital energies

Hydrogenic orbital

Hydrogenic orbital

Hydrogenic orbitals

Hydrogenic radial wavefunctions for successive 2p and 3p Rydberg orbitals

Molecular Orbitals for the Hydrogen Molecule-ion

Molecular orbital hydrogen bonding

Molecular orbital model hydrogen

Molecular orbital of hydrogen

Molecular orbital theory hydrogen molecule

Molecular orbitals hydrogen

Molecular orbitals hydrogen molecule, antibonding

Molecular orbitals in hydrogen

Molecular orbitals of hydrogen

Molecular orbitals the hydrogen molecule ion

Orbital correlation diagram hydrogen abstraction

Orbital energies in a hydrogen-like species

Orbital hydrogen-like

Orbital interactions hydrogen atom abstractions

Orbitals hydrogen-like atomic

Orbitals in hydrogen

Orbitals in hydrogen atoms

Orbitals of atoms other than hydrogen

Orbitals of hydrogen atom

Orbitals of the hydrogen atom

Orbitals ofthe Hydrogen Atom

Orbitals, antibonding hydrogen—like

Radial distribution functions hydrogen atomic orbitals

Relative sizes of hydrogenic orbitals and the probability criterion

Spherical harmonic functions hydrogen atom orbitals

Symmetry-Adapted Linear Combinations of Hydrogen Orbitals in Ammonia

The Atomic Orbitals of Hydrogen

The Atomic Orbitals of a Hydrogen Atom

The Characteristics of Hydrogen Orbitals

The Hydrogen Atom and Atomic Orbitals

The Hydrogen Molecule Molecular Orbitals

The Hydrogen Orbitals

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