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NBO 7.0: New vistas in localized and delocalized chemical bonding theory

Journal of computational chemistry, 2019-09, Vol.40 (25), p.2234-2241

2019

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NBO 6.0: Natural bond orbital analysis program

Journal of computational chemistry, 2013-06, Vol.34 (16), p.1429-1437

2013

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Natural bond orbital methods

Wiley interdisciplinary reviews. Computational molecular science, 2012-01, Vol.2 (1), p.1-42

2012

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Ligands for Practical Rhodium-Catalyzed Asymmetric Hydroformylation

Accounts of chemical research, 2007-12, Vol.40 (12), p.1251-1259

2007

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Unexpected CO Dependencies, Catalyst Speciation, and Single Turnover Hydrogenolysis Studies of Hydroformylation via High Pressure NMR Spectroscopy

Journal of the American Chemical Society, 2017-02, Vol.139 (7), p.2778-2785

2017

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All-Electron Scalar Relativistic Basis Sets for Third-Row Transition Metal Atoms

Journal of chemical theory and computation, 2008-06, Vol.4 (6), p.908-919

2008

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Zinc-Mediated Chain Transfer from Hafnium to Aluminum in the Hafnium-Pyridyl Amido-Catalyzed Polymerization of 1‑Octene Revealed by Job Plot Analysis

Organometallics, 2019-02, Vol.38 (4), p.926-932

2019

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The Hafnium-Pyridyl Amido-Catalyzed Copolymerization of Ethene and 1‑Octene: How Small Amounts of Ethene Impact Catalysis

ACS catalysis, 2019-04, Vol.9 (4), p.3338-3348

2019

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Immobilized Bisdiazaphospholane Catalysts for Asymmetric Hydroformylation

Journal of the American Chemical Society, 2014-06, Vol.136 (22), p.7943-7953

2014

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Mechanistic Studies of Hafnium-Pyridyl Amido-Catalyzed 1‑Octene Polymerization and Chain Transfer Using Quench-Labeling Methods

Journal of the American Chemical Society, 2017-08, Vol.139 (34), p.11903-11912

2017

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Bonding Analysis of TM(cAAC)2 (TM = Cu, Ag, and Au) and the Importance of Reference State

Organometallics, 2015-07, Vol.34 (13), p.3440-3447

2015

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Operando Spectroscopic and Kinetic Characterization of Aerobic Allylic C–H Acetoxylation Catalyzed by Pd(OAc)2/4,5-Diazafluoren-9-one

Journal of the American Chemical Society, 2019-07, Vol.141 (26), p.10462-10474

2019

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Enantioselective Hydroformylation of N-Vinyl Carboxamides, Allyl Carbamates, and Allyl Ethers Using Chiral Diazaphospholane Ligands

Journal of the American Chemical Society, 2010-10, Vol.132 (40), p.14027-14029

2010

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Experimental and Computational Investigation of the Aerobic Oxidation of a Late Transition Metal-Hydride

Journal of the American Chemical Society, 2019-07, Vol.141 (27), p.10830-10843

2019

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Stopped-Flow NMR: Determining the Kinetics of [rac-(C2H4(1-indenyl)2)ZrMe][MeB(C6F5)3]-Catalyzed Polymerization of 1-Hexene by Direct Observation

Journal of the American Chemical Society, 2010-08, Vol.132 (33), p.11461-11463

2010

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Chromophore Quench-Labeling: An Approach to Quantifying Catalyst Speciation As Demonstrated for (EBI)ZrMe2/B(C6F5)3‑Catalyzed Polymerization of 1‑Hexene

ACS catalysis, 2016-11, Vol.6 (11), p.7398-7408

2016

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Origin of Trans-Bent Geometries in Maximally Bonded Transition Metal and Main Group Molecules

Journal of the American Chemical Society, 2006-06, Vol.128 (22), p.7335-7345

2006

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Recent Developments in the Scope, Practicality, and Mechanistic Understanding of Enantioselective Hydroformylation

Accounts of chemical research, 2018-09, Vol.51 (9), p.2344-2354

2018

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Hydroformylation of pyrolysis oils to aldehydes and alcohols from polyolefin waste

Science (American Association for the Advancement of Science), 2023-08, Vol.381 (6658), p.660-666

2023

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Resonance Theory Reboot

Journal of the American Chemical Society, 2019-03, Vol.141 (10), p.4156-4166

2019

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Comment on "Observation of alkaline earth complexes M(CO) 8 (M = Ca, Sr, or Ba) that mimic transition metals"

Science (American Association for the Advancement of Science), 2019-08, Vol.365 (6453)

2019

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Discovering Chemistry With Natural Bond Orbitals

Weinhold, Frank

1. Aufl., 2012

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Construction and deconstruction of aldehydes by transfer hydroformylation

Science (American Association for the Advancement of Science), 2015-01, Vol.347 (6217), p.29-30

Landis, Clark R

2015

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Quantitative Validation of the Living Coordinative Chain-Transfer Polymerization of 1‑Hexene Using Chromophore Quench Labeling

Macromolecules, 2020-07, Vol.53 (14), p.5816-5825

2020

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Large-Scale Computational Modeling of [Rh(DuPHOS)]+-Catalyzed Hydrogenation of Prochiral Enamides: Reaction Pathways and the Origin of Enantioselection

Journal of the American Chemical Society, 2000-12, Vol.122 (51), p.12714-12727

2000

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NBO 7.0: New vistas in localized and delocalized chemical bonding theory

NBO 6.0: Natural bond orbital analysis program

Natural bond orbital methods

Ligands for Practical Rhodium-Catalyzed Asymmetric Hydroformylation

Unexpected CO Dependencies, Catalyst Speciation, and Single Turnover Hydrogenolysis Studies of Hydroformylation via High Pressure NMR Spectroscopy

All-Electron Scalar Relativistic Basis Sets for Third-Row Transition Metal Atoms

Zinc-Mediated Chain Transfer from Hafnium to Aluminum in the Hafnium-Pyridyl Amido-Catalyzed Polymerization of 1‑Octene Revealed by Job Plot Analysis

The Hafnium-Pyridyl Amido-Catalyzed Copolymerization of Ethene and 1‑Octene: How Small Amounts of Ethene Impact Catalysis

Immobilized Bisdiazaphospholane Catalysts for Asymmetric Hydroformylation

Mechanistic Studies of Hafnium-Pyridyl Amido-Catalyzed 1‑Octene Polymerization and Chain Transfer Using Quench-Labeling Methods

Bonding Analysis of TM(cAAC)2 (TM = Cu, Ag, and Au) and the Importance of Reference State

Operando Spectroscopic and Kinetic Characterization of Aerobic Allylic C–H Acetoxylation Catalyzed by Pd(OAc)2/4,5-Diazafluoren-9-one

Enantioselective Hydroformylation of N-Vinyl Carboxamides, Allyl Carbamates, and Allyl Ethers Using Chiral Diazaphospholane Ligands

Experimental and Computational Investigation of the Aerobic Oxidation of a Late Transition Metal-Hydride

Stopped-Flow NMR: Determining the Kinetics of [rac-(C2H4(1-indenyl)2)ZrMe][MeB(C6F5)3]-Catalyzed Polymerization of 1-Hexene by Direct Observation

Chromophore Quench-Labeling: An Approach to Quantifying Catalyst Speciation As Demonstrated for (EBI)ZrMe2/B(C6F5)3‑Catalyzed Polymerization of 1‑Hexene

Origin of Trans-Bent Geometries in Maximally Bonded Transition Metal and Main Group Molecules

Recent Developments in the Scope, Practicality, and Mechanistic Understanding of Enantioselective Hydroformylation

Hydroformylation of pyrolysis oils to aldehydes and alcohols from polyolefin waste

Resonance Theory Reboot

Comment on "Observation of alkaline earth complexes M(CO) 8 (M = Ca, Sr, or Ba) that mimic transition metals"

Discovering Chemistry With Natural Bond Orbitals

Construction and deconstruction of aldehydes by transfer hydroformylation

Quantitative Validation of the Living Coordinative Chain-Transfer Polymerization of 1‑Hexene Using Chromophore Quench Labeling

Large-Scale Computational Modeling of [Rh(DuPHOS)]+-Catalyzed Hydrogenation of Prochiral Enamides: Reaction Pathways and the Origin of Enantioselection

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