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06/2011
The morphometrical variability of six natural populations of Difflugia tuberspinifera was investigated using the statistic methods based on 374 samples from... 
Natural population | Testate amoebae | Difflugia tuberspinifera | Morphometry
Web Resource
Phenotypic and genetic variability in wild populations of dallis grass(Paspalum dilatatum   Poir.), 12/2002
Dallis grass ( Paspalum dilatatum   Poir.) is a warm season perennial grass of high forage value. The objective of this work was to get estimations of... 
natural population, native forage plants, degree of genetic determination, apomixis | poblaciones naturales, plantas forrajeras nativas, grado de determinación genética, apomixis
Journal
Journal of Chemical Theory and Computation, ISSN 1549-9618, 11/2013, Volume 9, Issue 11, pp. 4834 - 4843
Modem quantum chemistry can make quantitative predictions on an immense array of chemical systems. However, the interpretation of those predictions is often... 
NATURAL-POPULATION ANALYSIS | DENSITY-MATRIX | ELECTRONIC WAVE-FUNCTIONS | CORRELATED MOLECULAR CALCULATIONS | MINIMAL-BASIS | TRANSITION-STATE METHOD | MAIN-GROUP | PHYSICS, ATOMIC, MOLECULAR & CHEMICAL | OCCUPATION NUMBERS | CHEMISTRY, PHYSICAL | ENERGY DECOMPOSITION SCHEME | GAUSSIAN-BASIS SETS | Physics - Chemical Physics
Journal Article
European Journal of Organic Chemistry, ISSN 1434-193X, 11/2017, Volume 2017, Issue 42, pp. 6349 - 6353
Density functional theory calculations were used to reveal the mechanistic pathway of benzyne formation from a Kobayashi precursor, for which two methods were... 
Natural population analysis | Nucleophilic substitution | Reaction mechanisms | Arynes | Solvent effects | Analysis | Silicon
Journal Article
INORGANIC CHEMISTRY, ISSN 0020-1669, 01/2016, Volume 55, Issue 2, pp. 573 - 583
The molecular structures of a series of uranyl (UO22+) complexes in which the uranium center is equatorially coordinated by a first-row species are calculated... 
DENSITY | TH-CM | FINE-STRUCTURE | HYDROXIDE COMPLEXES | NATURAL-POPULATION | AB-INITIO | TOPOLOGICAL ANALYSIS | ACTINIDE COMPLEXES | ELECTRONIC-STRUCTURE CALCULATIONS | COUPLED CASPT2 CALCULATIONS | CHEMISTRY, INORGANIC & NUCLEAR
Journal Article
RSC Advances, ISSN 2046-2069, 2014, Volume 4, Issue 24, pp. 12078 - 12086
The CASSCF methodology is used to calculate the ground state electron densities of a series of seven actinocenes, AnCOT(2) (An = Th-Cm, COT = eta(8)-C8H8). The... 
DENSITY | SANDWICH COMPLEXES | STATES | LIGANDS | NATURAL-POPULATION | ATOMS | BASIS-SETS | ACTINIDE | CHEMISTRY, MULTIDISCIPLINARY | COUPLED CASPT2 CALCULATIONS | ELECTRONIC-STRUCTURE
Journal Article
Tetrahedron, ISSN 0040-4020, 10/2014, Volume 70, Issue 40, pp. 7158 - 7165
The structures and electronic properties of seven isomeric six-membered heterocyclic mesomeric betaines (HMBs) and four fully-covalent isomers have been... 
Cross-conjugated | Aromaticity | Semi-conjugated | Homodesmotic | Mesomeric betaine | NATURAL-POPULATION ANALYSIS | RING HETEROCYCLES | CHEMISTRY, ORGANIC | AROMATICITY INDEX | Heterocyclic compounds | Analysis
Journal Article
by Sadhu, B and Dolg, M
INORGANIC CHEMISTRY, ISSN 0020-1669, 08/2019, Volume 58, Issue 15, pp. 9738 - 9748
Soft donor ligands often provide higher selectivity for actinides(III) over chemically similar lanthanides(III), e.g., in the Am-III-Eu-III pair. Frequently,... 
DENSITY | ZETA VALENCE QUALITY | NATURAL-POPULATION | CORRELATION-ENERGY | M06 SUITE | BASIS-SETS | EFFICIENT SEPARATION | HARTREE-FOCK | EU-III | CHARGE DECOMPOSITION ANALYSIS | CHEMISTRY, INORGANIC & NUCLEAR
Journal Article
Nature Communications, ISSN 2041-1723, 12/2018, Volume 9, Issue 1, pp. 14 - 6
Metabolic rates and life history strategies are both thought to set the "pace of life", but whether they evolve in tandem is not well understood. Here, using a... 
SLOW PACE | WILD RODENT | EVOLUTION | NATURAL-POPULATION | MULTIDISCIPLINARY SCIENCES | GENETIC CORRELATIONS | GUPPIES POECILIA-RETICULATA | TRAITS | TRINIDADIAN GUPPIES | QUANTITATIVE GENETICS | BASAL | Metabolic rate | Life history | Populations | Animal behavior | Fish | Predation | Metabolism
Journal Article
Inorganic Chemistry, ISSN 0020-1669, 12/2018, Volume 57, Issue 23, pp. 14513 - 14523
We elucidated the separation mechanism between Am(III) and Cm(III) ions by using two different types of diamide ligands, diglycolamide (DGA) and alkylated... 
TRIVALENT | EXTRACTION | APPROXIMATION | ELECTRONIC POPULATION ANALYSIS | NATURAL-POPULATION | COMPLEXES | AM(III)/EU(III) SELECTIVITY | AM(III) | HARTREE-FOCK | MOSSBAUER ISOMER-SHIFTS | CHEMISTRY, INORGANIC & NUCLEAR
Journal Article
Chemical Communications, ISSN 1359-7345, 6/2017, Volume 53, Issue 5, pp. 6685 - 6695
Journal Article
REVISTA ARVORE, ISSN 0100-6762, 01/2016, Volume 40, Issue 1, pp. 51 - 60
We aimed in this work to study natural populations of copaiba (Copaifera multijuga Hayne) on the Monte Branco mountain at Porto Trombetas-PA, in order to... 
Biometrics | Natural population | Copaiba Oleoresin | FORESTRY
Journal Article
Computational and Theoretical Chemistry, ISSN 2210-271X, 12/2014, Volume 1050, pp. 15 - 22
The algorithms for constructing Natural Atomic Orbitals (NAOs) from a reduced one-particle density matrix as well as for Natural Population Analysis (NPA) are... 
Open-source | Java | Natural Population Analysis | Natural Atomic Orbitals | Atomic charges | CHEMISTRY, PHYSICAL | BOND ORBITAL ANALYSIS | ATOMIC ORBITALS | ORDER | WAVE-FUNCTIONS | INFORMATICS | PROGRAM | VALENCE | DENSITY-MATRICES
Journal Article
DALTON TRANSACTIONS, ISSN 1477-9226, 12/2018, Volume 47, Issue 46, pp. 16603 - 16615
In the context of the mitigation of the biological effects of internal radionuclide contamination and for efficient decorporation, the design and development... 
AROMATICITY | PLUTONIUM | NATURAL-POPULATION | COMPLEXES | CORRELATION-ENERGY | LANTHANOID(III) IONS | CHARGE DECOMPOSITION ANALYSIS | HYDRATION | AQUEOUS-SOLUTION | ELECTRON-DENSITY | CHEMISTRY, INORGANIC & NUCLEAR
Journal Article
Dalton Transactions, ISSN 1477-9226, 2018, Volume 47, Issue 46, pp. 16603 - 16615
In the context of the mitigation of the biological effects of internal radionuclide contamination and for efficient decorporation, the design and development... 
Journal Article
Transactions of the American Fisheries Society, ISSN 0002-8487, 05/2016, Volume 145, Issue 3, pp. 671 - 686
For salmon populations in the Columbia River and Snake River basins, many of which are listed under the U.S. Endangered Species Act of 1973, reliable estimates... 
WILD | FITNESS | FISHERIES | STEELHEAD | NATURAL-POPULATION | SALMON | POWER | LARGE-SCALE | COLUMBIA
Journal Article
Proceedings of the National Academy of Sciences of the United States of America, ISSN 0027-8424, 5/2011, Volume 108, Issue 18, pp. 7481 - 7486
Journal Article
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