Molecular orbital

Results: 277



#Item
221Abstract algebra / Eigenvalues and eigenvectors / Linear algebra / Matrix theory / Singular value decomposition / Radical / Pyridine / Algebra / Chemistry / Mathematics

Diagonalization and Hückel Molecular Orbital Theory Solving the HMO secular equation for complex molecules can become very difficult by hand. However, we may enlist the help of the computer. The solutions to the secular

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Source URL: www.colby.edu

Language: English - Date: 2014-04-29 14:06:39
222Stereochemistry / Molecular geometry / Theoretical chemistry / Orbital hybridisation / VSEPR theory / Chemical bond / Non-bonding orbital / Molecular orbital / Trigonal pyramidal molecular geometry / Chemistry / Chemical bonding / Quantum chemistry

5-1 Molecular Shapes Laboratory Introduction to VSEPR Theory This laboratory introduces the concept of Valence Shell Electron Pair Repulsion (VSEPR) theory and the molecular geometry and bonding that it describes. In th

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Source URL: www.webmo.net

Language: English - Date: 2008-07-25 14:35:21
223Stereochemistry / Molecular orbital / Theoretical chemistry / Orbital hybridisation / Email / Atom / Delta bond / Chemistry / Chemical bonding / Quantum chemistry

GETTING STARTED WITH WEBMO To build molecule: 1. Touch “Build” 2. Choose atom (C, O, N, H, or Periodic Table) 3. Tap to insert atom and/or drag to insert bond 4. Choose Cleanup: Comprehensive to finish

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Source URL: www.webmo.net

Language: English - Date: 2014-01-26 15:29:15
224Emerging technologies / Atomic physics / Nanomaterials / Molecular physics / Graphene / Graphite oxide / X-ray photoelectron spectroscopy / Carbon nanotube / Orbital hybridisation / Chemistry / Physics / Quantum chemistry

Core level binding energies of functionalized and defective graphene Toma Susi*1,2, Markus Kaukonen1,3, Paula Havu1,4, Mathias P. Ljungberg5,

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Source URL: www.ncbi.nlm.nih.gov

Language: English
225Theoretical chemistry / Quantum chemistry / Computational chemistry / Chemist / Molecular orbital theory / Molecular orbital / Molecular dynamics / Quantum mechanics / Hartree–Fock method / Chemistry / Science / Physics

An Introduction to Theoretical Chemistry, Second Edition Jack Simons* Chemistry Department

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Source URL: simons.hec.utah.edu

Language: English - Date: 2011-05-26 10:58:29
226Quantum chemistry / Chemical bonding / Theoretical chemistry / Molecular physics / Electron configuration / Atomic orbital / Valence electron / Aufbau principle / Hartree–Fock method / Chemistry / Physics / Atomic physics

Transition Metals and the Aufbau Principle L. G. Vanquickenborne, K. Pierloot, and D. Devoghel

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Source URL: depa.fquim.unam.mx

Language: English - Date: 2014-01-27 14:50:35
227Quantum chemistry / Molecular physics / Chemical properties / Ions / Atomic orbital / Ionization energy / Electron / Ionization / Energy level / Chemistry / Physics / Atomic physics

Correspondences Between the Classical Electrostatic Thomson Problem and Atomic Electronic Structure Tim LaFave Jr.1,∗

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Source URL: www.pagesofmind.com

Language: English - Date: 2013-11-30 10:29:08
228Theoretical chemistry / Density functional theory / Computational chemistry / Quantum chemistry / Materials Studio / Electronic band structure / Molecular orbital / Chemistry / Science / Crystal

DATASHEET DMol3

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Source URL: accelrys.com

Language: English - Date: 2011-08-30 15:56:15
229Molecular orbital / Antibonding / Pi bond / Atomic orbital / Chemical bond / Sigma bond / Electron configuration / Linear combination of atomic orbitals / Energy level / Chemistry / Chemical bonding / Quantum chemistry

CHEMISTRY The Molecular Science

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Source URL: www.sinc.sunysb.edu

Language: English - Date: 2007-02-08 09:16:46
230Atomic physics / Chemical bonding / Theoretical chemistry / Molecular physics / Molecular orbital / Atomic orbital / Electron configuration / Chemical bond / Hartree–Fock method / Chemistry / Physics / Quantum chemistry

R O B E R T S . M U L L I K E N* Spectroscopy, molecular orbitals,

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Source URL: www.nobelprize.org

Language: English - Date: 2006-05-31 16:47:04
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