7,534 Works

{(t-Bu)C)2C3 dimerisation TS Def2-SVPP G = -2270.690099 DG = 101.7

Henry Rzepa
Gaussian 16 calculation

YUHJUG charge =0.4

Henry Rzepa
Gaussian 16 calculation

IR data

Richard Yuze Kong
IR Data.

Molecules with very large dipole moments: cyclopropenium acetylide

Henry Rzepa

(Supplementary Data) Analytical assessment of Kelvin-Helmholtz instability growth at Ganymede’s upstream magnetopause

Nawapat Kaweeyanun
This deposit provides supplementary data used to produce figures in a journal article titled "Analytical assessment of Kelvin-Helmholtz Instability growth at Ganymede’s upstream magnetopause"

(t-Bu)4C optrot

Henry Rzepa
Gaussian Calculation

FEHYOG

Henry Rzepa
Gaussian 16 calculation

Pre-Reactant b3lyp/Def2-svpp, three THF solvents without aldehyde G = -1441.414939

Henry Rzepa
Gaussian 16 (C01) calculation

Acetone-CFCl3-wb97xd-def2svpp

Alexandre Dumon
Gaussian Calculation

Acetonitrile-CFCl3-wb97xd-augpvdz

Alexandre Dumon
Gaussian Calculation

MeOH-CFCl3-wb97xd-def2svpp

Alexandre Dumon
Gaussian Calculation

MeOH-CFCl3-wb97xd-augpcSseq1

Alexandre Dumon
Gaussian Calculation

Dichloromethane-CF3COOH-wb97xd-augpcSseq1

Alexandre Dumon
Gaussian Calculation

MeOH-CF3COOH-wb97xd-augpcSseq1

Alexandre Dumon
Gaussian Calculation

Fluoroethane-diethylether-wb97xd/def2svpp

Alexandre Dumon
Gaussian 16 (C01) calculation

Fluoroethane-Chloroform-wb97xd/aug-cc-pcSeq1

Alexandre Dumon
Gaussian 16 (C01) calculation

C6H5F-DCM-wb97xd/aug-pcSseq1

Alexandre Dumon
Gaussian 16 (C01) calculation

C6H5CF3-Acetonitrile-wb97xd/aug-pcSseq1

Alexandre Dumon
Gaussian 16 (C01) calculation

Fluoroform-Benzene-wb97xd/aug-pcSseq1

Alexandre Dumon
Gaussian 16 (C01) calculation

Fluoroform-DMSO-wb97xd/def2svpp

Alexandre Dumon
Gaussian 16 (C01) calculation

difluoro(phenyl)borane-hexan-wb97xd/aug-pcSseq1

Alexandre Dumon
Gaussian 16 (C01) calculation

difluoro(phenyl)borane-hexan-wb97xd/def2svpp

Alexandre Dumon
Gaussian 16 (C01) calculation

Acetone-CFCl3-B3LYP+GD3BJ/def2svpp

Alexandre Dumon
Gaussian 16 (C01) calculation

Acetonitrile-CFCl3-MP2-NMR

Alexandre Dumon
Gaussian Calculation

Toluene-CFCl3-wb97xd-augpvdz

Alexandre Dumon
Gaussian Calculation

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