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Subject: Chemistry Subject: Physics

1 to 10 of 83 Results

DatasetSupporting file with the individual values of the average relative errors for 155 hybrid functionals for the CCSD(T) benchmark set for the article A comprehensive assessment of hybrid KS DFT functionals, V. Kumar, S. Śmiga, and I. Grabowski May 23, 2024 - DataversePhysical sciences Grabowski, Ireneusz; Szymon Śmiga; Vignesh Kumar, 2024, "Supporting file with the individual values of the average relative errors for 155 hybrid functionals for the CCSD(T) benchmark set for the article A comprehensive assessment of hybrid KS DFT functionals, V. Kumar, S. Śmiga, and I. Grabowski", https://doi.org/10.18150/V4XZSF, RepOD, V1
DatasetInflection Point in Pressure Dependence of Ionic Conductivity as a Fingerprint of Local Structure Formation May 22, 2024 - DataverseUniversity of Silesia in Katowice Wojnarowska, Żaneta; Koymeth, Soorya; Yao, Beibei; Paluch, Marian; Dulski, Mateusz; Swadzba-Kwasny, Malgorzata, 2024, "Inflection Point in Pressure Dependence of Ionic Conductivity as a Fingerprint of Local Structure Formation", https://doi.org/10.18150/QLLWAF, RepOD, V1
DatasetKorelacje między strukturą supramolekularną, dynamiką molekularną, stabilnością fizyko-chemiczną i rozpuszczalnością w czystych farmaceutycznych substancjach aktywnych (APIs) oraz systemach binarnych API-substancja pomocnicza May 17, 2024 Jurkiewicz, Karolina, 2023, "Korelacje między strukturą supramolekularną, dynamiką molekularną, stabilnością fizyko-chemiczną i rozpuszczalnością w czystych farmaceutycznych substancjach aktywnych (APIs) oraz systemach binarnych API-substancja pomocnicza", https://doi.org/10.18150/VVVMK8, RepOD, V7
DatasetAdvancements in Surface-Enhanced Femtosecond Stimulated Raman Spectroscopy: Exploring Factors Influencing Detectability and Shapes of Spectra May 10, 2024 - DataverseInstitute of Physical Chemistry PAS Pyrcz, Patryk; Gawinkowski, Sylwester, 2024, "Advancements in Surface-Enhanced Femtosecond Stimulated Raman Spectroscopy: Exploring Factors Influencing Detectability and Shapes of Spectra", https://doi.org/10.18150/U0OXIC, RepOD, V1
DatasetDynamics of Water Clusters Confined in Ionic Liquid at an Elevated Pressure Apr 15, 2024 - DataversePhysical sciences Kumar Murali, Amith; Wojnarowska, Zaneta; Paluch, Marian; Casalini, Riccardo; Lange, Alyna; Taubert, Andreas, 2024, "Dynamics of Water Clusters Confined in Ionic Liquid at an Elevated Pressure", https://doi.org/10.18150/YVIIBU, RepOD, V1
DatasetHigh-pressure phase transitions and vibrational properites of NaZnF3 Mar 28, 2024 Kurzydłowski, Dominik; Pillai, Sharad Babu; Dziarnowska, Anna; Mazej, Zoran, 2024, "High-pressure phase transitions and vibrational properites of NaZnF3", https://doi.org/10.18150/KUURYC, RepOD, V1
DatasetEnergie linii rentgenowskich Ka i Kb wraz z intensywnościami dla poszczególnych pierwiastków Mar 25, 2024 - DataverseChemical sciences Syrocki, Łukasz, 2024, "Energie linii rentgenowskich Ka i Kb wraz z intensywnościami dla poszczególnych pierwiastków", https://doi.org/10.18150/QV8ZNK, RepOD, V2
DatasetStosunki intensywności linii Kb/Ka Mar 25, 2024 - DataverseChemical sciences Syrocki, Łukasz, 2024, "Stosunki intensywności linii Kb/Ka", https://doi.org/10.18150/LCF5UZ, RepOD, V2
DatasetData for the article doi:https:10.1016/bs.aiq.2023.01.003 Mar 22, 2024 - DataversePhysical sciences Grabowski, Ireneusz; Szymon, Smiga; Vignesh Kumar; Adisti Singh, 2024, "Data for the article doi:https:10.1016/bs.aiq.2023.01.003", https://doi.org/10.18150/QTS88L, RepOD, V1
DatasetData for publication "Theory and simulations of ionic liquids in nanoconfinement" Mar 21, 2024 - DataverseInstitute of Physical Chemistry PAS Kondrat, Svyatoslav, 2024, "Data for publication "Theory and simulations of ionic liquids in nanoconfinement"", https://doi.org/10.18150/CWK09A, RepOD, V1

Supporting file with the individual values of the average relative errors for 155 hybrid functionals for the CCSD(T) benchmark set for the article A comprehensive assessment of hybrid KS DFT functionals, V. Kumar, S. Śmiga, and I. Grabowski

May 23, 2024 - Physical sciences

Grabowski, Ireneusz; Szymon Śmiga; Vignesh Kumar, 2024, "Supporting file with the individual values of the average relative errors for 155 hybrid functionals for the CCSD(T) benchmark set for the article A comprehensive assessment of hybrid KS DFT functionals, V. Kumar, S. Śmiga, and I. Grabowski", https://doi.org/10.18150/V4XZSF, RepOD, V1

Inflection Point in Pressure Dependence of Ionic Conductivity as a Fingerprint of Local Structure Formation

May 22, 2024 - University of Silesia in Katowice

Wojnarowska, Żaneta; Koymeth, Soorya; Yao, Beibei; Paluch, Marian; Dulski, Mateusz; Swadzba-Kwasny, Malgorzata, 2024, "Inflection Point in Pressure Dependence of Ionic Conductivity as a Fingerprint of Local Structure Formation", https://doi.org/10.18150/QLLWAF, RepOD, V1

Korelacje między strukturą supramolekularną, dynamiką molekularną, stabilnością fizyko-chemiczną i rozpuszczalnością w czystych farmaceutycznych substancjach aktywnych (APIs) oraz systemach binarnych API-substancja pomocnicza

May 17, 2024

Jurkiewicz, Karolina, 2023, "Korelacje między strukturą supramolekularną, dynamiką molekularną, stabilnością fizyko-chemiczną i rozpuszczalnością w czystych farmaceutycznych substancjach aktywnych (APIs) oraz systemach binarnych API-substancja pomocnicza", https://doi.org/10.18150/VVVMK8, RepOD, V7

Advancements in Surface-Enhanced Femtosecond Stimulated Raman Spectroscopy: Exploring Factors Influencing Detectability and Shapes of Spectra

May 10, 2024 - Institute of Physical Chemistry PAS

Pyrcz, Patryk; Gawinkowski, Sylwester, 2024, "Advancements in Surface-Enhanced Femtosecond Stimulated Raman Spectroscopy: Exploring Factors Influencing Detectability and Shapes of Spectra", https://doi.org/10.18150/U0OXIC, RepOD, V1

Dynamics of Water Clusters Confined in Ionic Liquid at an Elevated Pressure

Apr 15, 2024 - Physical sciences

Kumar Murali, Amith; Wojnarowska, Zaneta; Paluch, Marian; Casalini, Riccardo; Lange, Alyna; Taubert, Andreas, 2024, "Dynamics of Water Clusters Confined in Ionic Liquid at an Elevated Pressure", https://doi.org/10.18150/YVIIBU, RepOD, V1

High-pressure phase transitions and vibrational properites of NaZnF3

Mar 28, 2024

Kurzydłowski, Dominik; Pillai, Sharad Babu; Dziarnowska, Anna; Mazej, Zoran, 2024, "High-pressure phase transitions and vibrational properites of NaZnF3", https://doi.org/10.18150/KUURYC, RepOD, V1

Energie linii rentgenowskich Ka i Kb wraz z intensywnościami dla poszczególnych pierwiastków

Mar 25, 2024 - Chemical sciences

Syrocki, Łukasz, 2024, "Energie linii rentgenowskich Ka i Kb wraz z intensywnościami dla poszczególnych pierwiastków", https://doi.org/10.18150/QV8ZNK, RepOD, V2

Stosunki intensywności linii Kb/Ka

Mar 25, 2024 - Chemical sciences

Syrocki, Łukasz, 2024, "Stosunki intensywności linii Kb/Ka", https://doi.org/10.18150/LCF5UZ, RepOD, V2

Data for the article doi:https:10.1016/bs.aiq.2023.01.003

Mar 22, 2024 - Physical sciences

Grabowski, Ireneusz; Szymon, Smiga; Vignesh Kumar; Adisti Singh, 2024, "Data for the article doi:https:10.1016/bs.aiq.2023.01.003", https://doi.org/10.18150/QTS88L, RepOD, V1

Data for publication "Theory and simulations of ionic liquids in nanoconfinement"

Mar 21, 2024 - Institute of Physical Chemistry PAS

Kondrat, Svyatoslav, 2024, "Data for publication "Theory and simulations of ionic liquids in nanoconfinement"", https://doi.org/10.18150/CWK09A, RepOD, V1

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