Do QTAIM metrics correlate with the strength of heavy element-ligand bonds? - Wikidata - wikimedia - TriplyDB

Do QTAIM metrics correlate with the strength of heavy element-ligand bonds?

Do QTAIM metrics correlate with the strength of heavy element-ligand bonds?

http://www.wikidata.org/entity/Q54159391

about

Metal-Metal Bonding in Uranium-Group 10 Complexes Computational study of An-X bonding (An = Th, U; X = p-block-based ligands) in pyrrolic macrocycle-supported complexes from the quantum theory of atoms in molecules and bond energy decomposition analysis.The selectivity of diglycolamide (TODGA) and bis-triazine-bipyridine (BTBP) ligands in actinide/lanthanide complexation and solvent extraction separation - a theoretical approach.Characterizing pressure-induced uranium C-H agostic bonds.Thorium-ligand multiple bonds via reductive deprotection of a trityl group.Ionic adsorption on the brucite (0001) surface: A periodic electrostatic embedded cluster method study.Harnessing redox activity for the formation of uranium tris(imido) compounds.Seventeen-Coordinate Actinide Helium Complexes.The shortest Th-Th distance from a new type of quadruple bond.Theoretically unraveling the separation of Am(iii)/Eu(iii): insights from mixed N,O-donor ligands with variations of central heterocyclic moieties.

P2860

Q28602457-2450B871-3302-4AF1-8AD8-7C51D92671F3 Q39089664-B7CE79AF-DF6D-4C15-8FF5-5421E393EBA1 Q41732334-D20280CF-6058-4F20-A13E-D4F9495B51F9 Q42389835-09E8878D-3B5A-4264-AAE8-6BAC511D2A5D Q46196773-E95C424A-5170-4830-8588-2C4D598D23B6 Q46451606-3B1D7EF7-F224-43A4-8C36-5CCCA8F32487 Q46835810-308DD1B6-0FDF-4869-A87B-C93571C9D94A Q48139235-8B6A67B7-A57F-497F-9D03-D4AB1F8CD680 Q48341026-FC5A0ADF-9156-4481-9FED-2625AF45BC68 Q49686730-BAC8B857-8219-4BE9-AF0B-144BFEA873F6

P2860

Do QTAIM metrics correlate with the strength of heavy element-ligand bonds?

http://www.wikidata.org/entity/Q54159391

description

2013 nî lūn-bûn

@nan

2013年の論文

@ja

2013年学术文章

@wuu

2013年学术文章

@zh-cn

2013年学术文章

@zh-hans

2013年学术文章

@zh-my

2013年学术文章

@zh-sg

2013年學術文章

@yue

2013年學術文章

@zh

2013年學術文章

@zh-hant

name

Do QTAIM metrics correlate with the strength of heavy element-ligand bonds?

@en

Do QTAIM metrics correlate with the strength of heavy element-ligand bonds?

@nl

type

label

Do QTAIM metrics correlate with the strength of heavy element-ligand bonds?

@en

Do QTAIM metrics correlate with the strength of heavy element-ligand bonds?

@nl

prefLabel

Do QTAIM metrics correlate with the strength of heavy element-ligand bonds?

@en

Do QTAIM metrics correlate with the strength of heavy element-ligand bonds?

@nl

P1433

Q54159391-CE895BE3-2306-4F71-9266-513ADEABFA61

P1476

Q54159391-A90CA2B5-2A6F-4D77-8892-E834AB440434

P2093

Q54159391-A46E34D9-A4E7-47DB-8DA1-6C61ACB82FF6

P2860

Q54159391-09A1438E-7F42-4CFB-8FE2-FCAC4819A675

Q54159391-13C8F68B-1297-4C7A-9CF3-E3E12E6B4A32

Q54159391-14662992-BAD0-42F5-9975-7E6993EE786D

Q54159391-1B767CD1-A8C7-4912-86BD-D976E4067D37

Q54159391-22D001D3-67F1-4B6D-B040-BB588F10E58E

Q54159391-338DEE45-C678-45AD-9147-235A84CA2091

Q54159391-3EE8A79B-94E3-4D7E-B38F-990D3594FD7E

Q54159391-4718B9F7-B11C-44A1-9712-A9E506669A96

Q54159391-49DDE5AA-158A-4D97-82DC-C442C1238ABC

Q54159391-4D679F3B-DA9B-4834-BCF6-B4436309266D

P304

Q54159391-45F4737E-F114-41B6-BB1C-F366E3842BF0

P31

Q54159391-ABA79E9E-25C0-4E03-B6AB-91BB1FEC885C

P356

Q54159391-9B4B5051-BA20-4DDA-99CC-FFC09A664D5E

P407

Q54159391-1793B18F-997B-467D-91A7-918BAC988AA4

P433

Q54159391-5B4D937A-F858-4C59-8C3B-8E108E1771D7

P478

Q54159391-E42FF41C-54AC-4DFB-9C1B-5F33474A3AF6

P50

Q54159391-BDC000CB-BB3F-4879-A8E8-7EB37F9E223F

P577

Q54159391-8440EA5C-4286-4723-95AE-8B6C0A9261FC

P698

Q54159391-9BA094CF-1C77-4342-A4BC-E8CC5609E846

P921

Q54159391-F0B3DE22-3938-4C58-AAF3-885084B96DE1

P356

P1433

Dalton Transactions

P1476

Do QTAIM metrics correlate with the strength of heavy element-ligand bonds?

@en

P2093

Abigail R E Mountain

http://www.w3.org/2001/XMLSchema#string

P2860

Density-functional exchange-energy approximation with correct asymptotic behavior

Generalized Gradient Approximation Made Simple

Accurate spin-dependent electron liquid correlation energies for local spin density calculations: a critical analysis

Density-functional approximation for the correlation energy of the inhomogeneous electron gas

Characterization and comparison of Cm(III) and Eu(III) complexed with 2,6-di(5,6-dipropyl-1,2,4-triazin-3-yl)pyridine using EXAFS, TRFLS, and quantum-chemical methods.

6-(3,5-Dimethyl-1H-pyrazol-1-yl)-2,2'-bipyridine as ligand for actinide(III)/lanthanide(III) separation.

Prescription for the design and selection of density functional approximations: more constraint satisfaction with fewer fits.

Complexes formed between the quadridentate, heterocyclic molecules 6,6'-bis-(5,6-dialkyl-1,2,4-triazin-3-yl)-2,2'-bipyridine (BTBP) and lanthanides(III): implications for the partitioning of actinides(III) and lanthanides(III).

Does covalency increase or decrease across the actinide series? Implications for minor actinide partitioning.

Toward a clear-cut vision on the origin of 2,6-di(1,2,4-triazin-3-yl)pyridine selectivity for trivalent actinides: insights from theory.

P304

13477-13486

http://www.w3.org/2001/XMLSchema#string

P31

scholarly article

P356

10.1039/C3DT51337H

http://www.w3.org/2001/XMLSchema#string

P407

P433

37

http://www.w3.org/2001/XMLSchema#string

P478

42

http://www.w3.org/2001/XMLSchema#string

P50

Nikolas Kaltsoyannis

P577

2013-07-30T00:00:00Z

http://www.w3.org/2001/XMLSchema#dateTime

P698

23897486

http://www.w3.org/2001/XMLSchema#string

P921