Rudolf Naef - Search Results

Year	Number of Results
2015	1
2017	2
2018	1
2019	1
2020	1
2021	2
2022	0

1

Revision and Extension of a Generally Applicable Group-Additivity Method for the Calculation of the Standard Heat of Combustion and Formation of Organic Molecules.

Naef R, Acree WE Jr. Naef R, et al. Molecules. 2021 Oct 10;26(20):6101. doi: 10.3390/molecules26206101. Molecules. 2021. PMID: 34684682 Free PMC article.

2

Calculation of the Vapour Pressure of Organic Molecules by Means of a Group-Additivity Method and Their Resultant Gibbs Free Energy and Entropy of Vaporization at 298.15 K.

Naef R, Acree WE Jr. Naef R, et al. Molecules. 2021 Feb 17;26(4):1045. doi: 10.3390/molecules26041045. Molecules. 2021. PMID: 33671251 Free PMC article.

3

Calculation of the Isobaric Heat Capacities of the Liquid and Solid Phase of Organic Compounds at 298.15K by Means of the Group-Additivity Method.

Naef R. Naef R. Molecules. 2020 Mar 4;25(5):1147. doi: 10.3390/molecules25051147. Molecules. 2020. PMID: 32143381 Free PMC article.

4

Calculation of the Isobaric Heat Capacities of the Liquid and Solid Phase of Organic Compounds at and around 298.15 K Based on Their "True" Molecular Volume.

Naef R. Naef R. Molecules. 2019 Apr 24;24(8):1626. doi: 10.3390/molecules24081626. Molecules. 2019. PMID: 31022983 Free PMC article.

5

Calculation of Five Thermodynamic Molecular Descriptors by Means of a General Computer Algorithm Based on the Group-Additivity Method: Standard Enthalpies of Vaporization, Sublimation and Solvation, and Entropy of Fusion of Ordinary Organic Molecules and Total Phase-Change Entropy of Liquid Crystals.

Naef R, Acree WE. Naef R, et al. Molecules. 2017 Jun 25;22(7):1059. doi: 10.3390/molecules22071059. Molecules. 2017. PMID: 28672839 Free PMC article.

6

A Generally Applicable Computer Algorithm Based on the Group Additivity Method for the Calculation of Seven Molecular Descriptors: Heat of Combustion, LogPO/W, LogS, Refractivity, Polarizability, Toxicity and LogBB of Organic Compounds; Scope and Limits of Applicability.

Naef R. Naef R. Molecules. 2015 Oct 7;20(10):18279-351. doi: 10.3390/molecules201018279. Molecules. 2015. PMID: 26457702 Free PMC article.

7

Application of a General Computer Algorithm Based on the Group-Additivity Method for the Calculation of Two Molecular Descriptors at Both Ends of Dilution: Liquid Viscosity and Activity Coefficient in Water at Infinite Dilution.

Naef R, Acree WE. Naef R, et al. Molecules. 2017 Dec 21;23(1):5. doi: 10.3390/molecules23010005. Molecules. 2017. PMID: 29267187 Free PMC article.

8

Calculation of the Surface Tension of Ordinary Organic and Ionic Liquids by Means of a Generally Applicable Computer Algorithm Based on the Group-Additivity Method.

Naef R, Acree WE. Naef R, et al. Molecules. 2018 May 20;23(5):1224. doi: 10.3390/molecules23051224. Molecules. 2018. PMID: 29783775 Free PMC article.

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