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Darwinocoris australicus
Known as:
Darwinocoris australicus Slater
National Institutes of Health
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Papers overview
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2018
2018
Development of a Multicenter Density Functional Tight Binding Model for Plutonium Surface Hydriding.
N. Goldman
,
B. Aradi
,
R. Lindsey
,
L. Fried
Journal of Chemical Theory and Computation
2018
Corpus ID: 4785644
We detail the creation of a multicenter density functional tight binding (DFTB) model for hydrogen on δ-plutonium, using a…
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2017
2017
The Bethe-Slater curve revisited; new insights from electronic structure theory
R. Cardias
,
A. Szilva
,
+7 authors
Y. Kvashnin
Scientific Reports
2017
Corpus ID: 2310191
The Bethe-Slater (BS) curve describes the relation between the exchange coupling and interatomic distance. Based on a simple…
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2017
2017
Numerical Optimization of Density Functional Tight Binding Models: Application to Molecules Containing Carbon, Hydrogen, Nitrogen, and Oxygen.
A. Krishnapriyan
,
P. Yang
,
A. Niklasson
,
M. Cawkwell
Journal of Chemical Theory and Computation
2017
Corpus ID: 3856859
New parametrizations for semiempirical density functional tight binding (DFTB) theory have been developed by the numerical…
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2015
2015
Band structure and electron-phonon coupling in H3S: A tight-binding model
L. Ortenzi
,
E. Cappelluti
,
L. Pietronero
2015
Corpus ID: 119243270
We present a robust tight-binding description, based on the Slater-Koster formalism, of the band structure of H$_3$S in the {\em…
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2014
2014
Life Expectancy and Mother-Baby Interventions. Evidence from A Historical Trial
S. Bhalotra
,
M. Karlsson
,
Thérèse H. Nilsson
2014
Corpus ID: 68855549
This paper investigates the potential of maternal and infant health programs to improve the life expectancy of women and children…
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Highly Cited
1997
Highly Cited
1997
Repulsive interatomic potentials calculated using Hartree-Fock and density-functional theory methods
K. Nordlund
,
N. Runeberg
,
D. Sundholm
1997
Corpus ID: 54699790
Highly Cited
1995
Highly Cited
1995
True Bugs of the World (Hemiptera: Heteroptera). Classification and Natural History by Schuh Slater, Randall T. Slater, James A. Slater
N. Andersen
1995
Corpus ID: 90585727
Review
1990
Review
1990
Solution of the Hartree-Fock Equations tor Atoms and Diatomic Moleeules with the Finite Element Method
D. Heinemann
,
A. Rosén
,
B. Fricke
1990
Corpus ID: 43440362
mentioned above. A review of the basis sets used in the quantum chemical calculations is given by Wilson [13]. The new…
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1986
1986
Transferable nonorthogonal tight-binding parameters for silicon.
Allen
,
Broughton
,
McMahan
Physical Review B (Condensed Matter)
1986
Corpus ID: 32630617
Nonorthogonal Slater-Koster (''tight-binding'') parameters have been fitted to linear muffin-tin orbital band structures of…
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1980
1980
Hartree—fock—slater-LCAO calculations on [Fe4S4(SH)4]0, 2−,3−: a model for the 4-Fe active site in high potential iron protein and ferredoxin
P. Geurts
,
J. W. Gosselink
,
A. Avoird
,
E. Baerends
,
J. G. Snijders
1980
Corpus ID: 51753698
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