Results 131 to 140 of about 83,082 (173)

Formation of configurable uniform CdSeTe thin films by close-space sublimation deposition of multiple alternating CdSe and CdTe layers. [PDF]

Sci Technol Adv Mater
Jundt P, Zywitzki O, Modes T, Baitule S, Arndt R, Späth B, Siepchen B.   +6 more
europepmc   +1 more source

A benchmark study of force fields implemented in CSD software. [PDF]

Struct Chem
Hunnisett LM, Sacchi P, Maloney AGP.
europepmc   +1 more source

Thermodynamic Insights on the Structure-Property Relationships in Substituted Benzenes: Are the Pairwise Interactions in Tri-Substituted Methyl-Nitro-Benzoic Acids Still Valid? [PDF]

Chempluschem
Silva Ferraz JM, Emel'yanenko VN, Zaitsau DH, Samarov AA, Brunetti B, Ciccioli A, Vecchio Ciprioti S, Verevkin SP.   +7 more
europepmc   +1 more source

Selenium-induced curvature control enables polymorphism in borabuckybowls. [PDF]

Chem Sci
Ikeno A, Hayakawa M, Masunaga N, Ueda A, Hatakeyama T.   +4 more
europepmc   +1 more source

Machine Learning Densities, Detonation Velocities, and Formation Enthalpies of Energetic Materials Using Quantum Chemistry Descriptors. [PDF]

J Chem Theory Comput
Kimber P, Mattock J, Wheeler S, Mullaney J, Beardah A, Fellows J, Jolley K, Plasser F.   +7 more
europepmc   +1 more source

BEST-CSP Benchmark Study of Polymorphs I and II of Sulfamerazine and the Perils of Polytype Polymorphs. [PDF]

Cryst Growth Des
Wood WP, Arhangelskis M, Bartůňková E, Bernardes CES, Boese AD, Braun DE, Bučar DK, Butkiewicz H, Červinka C, Civalleri B, Couvrat N, de Ronde E, Donà L, Dračínský M, Firaha D, Fulem M, Geronia Ii R, Goncharova N, Gryl M, Hoja J, Hoser A, Krzeszczakowska J, List A, Lončarić I, Mladineo B, Nyman J, Olehovics E, Raimondo M, Rietveld IB, Rodrigues RIS, Russo L, Salvalaglio M, Sarraguça M, Šnajdr J, Štejfa V, Sun G, Tinnemans P, Whitfield PS, Yang Z, Zhang Y, Price SL.   +40 more
europepmc   +1 more source

Solubility of Metal Precursors in Supercritical CO₂: Measurements and Correlations. [PDF]

Molecules
Crone M, Türk M.
europepmc   +1 more source

Experimental and thermodynamic modeling of sumatriptan solubility in supercritical carbon dioxide for green pharmaceutical applications. [PDF]

Sci Rep
Bawazeer S.
europepmc   +1 more source

Practical feature filter strategy to machine learning for small datasets in chemistry. [PDF]

Sci Rep
Hu Y, Sandt R, Spatschek R.
europepmc   +1 more source

Determination of the solubility of methyldopa in supercritical carbon dioxide for drug delivery applications: thermal analysis. [PDF]

Sci Rep
Wali AF, Sridhar SB, Talath S, Pillai JR, Shareef J, Bhupathyraaj M, Goud BKM, Hani U.   +7 more
europepmc   +1 more source