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Zero differential overlap
Known as:
Zero-differential overlap
Zero differential overlap is an approximation in computational molecular orbital theory that is the central technique of semi-empirical methods in…
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14 relations
Ab initio quantum chemistry methods
Austin Model 1
CNDO/2
INDO
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Broader (1)
Computational chemistry
Papers overview
Semantic Scholar uses AI to extract papers important to this topic.
2018
2018
Chemical Fragmentation for Molecular Orbital Calculations on Proteins
Gabor Naray-Szab
2018
Corpus ID: 46007652
The conceptual and mathemaitical basis of a molecular orbital method which enables the calculation. of conformational energy…
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2013
2013
Sequence-Dependence of DX DNA Electronic Properties and Thermal Fluctuations
Will Zhang
2013
Corpus ID: 92934823
The Watson-Crick base-pairing of DNA has been exploited through sticky-end cohesion and branched junctions to create complex self…
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1980
1980
INTERPRETATION OF DATA OBTAINED FROM MÖSSBAUER, ESR, SUSCEPTIBILITY, OPTICAL AND XPS MEASUREMENTS
A. Trautwein
1980
Corpus ID: 35346563
Molecular o r b i t a l c a l c u l a t i o n s a r e designed t o c a l c u l a t e t h e e lect r o n i c and magnetic s t r u…
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1972
1972
THE EXACT HARTREE-FOCK PROBLEM FOR LITHIUM CRYSTALS : A PRELIMINARY REPORT
F. Harris
,
L. Kumar
,
H. Monkhorst
1972
Corpus ID: 97962696
Results preliminary to exact Hartree-Fock calculations for cubic lithium crystals are obtained by a method recently developed by…
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