Search Results - "Ngaojampa, Chanisorn"

Nuclear quantum and H/D isotope effects on three‐centered bonding diborane: Path integral molecular dynamics simulations by Daengngern, Rathawat, Kobayashi, Osamu, Kungwan, Nawee, Ngaojampa, Chanisorn, Tachikawa, Masanori

“…Nuclear quantum and H/D isotope effects of bridging and terminal hydrogen atoms of diborane (B2H6) molecules were systematically studied by classical ab initio…”
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Solvent Dependence of Double Proton Transfer in the Formic Acid–Formamidine Complex: Path Integral Molecular Dynamics Investigation by Kungwan, Nawee, Ngaojampa, Chanisorn, Ogata, Yudai, Kawatsu, Tsutomu, Oba, Yuki, Kawashima, Yukio, Tachikawa, Masanori

“…Solvent dependence of double proton transfer in the formic acid–formamidine (FA–FN) complex at room temperature was investigated by means of ab initio path…”
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Asymmetric hydrogen bonding in formic acid–nitric acid dimer observed by quantum molecular dynamics simulations by Ngaojampa, Chanisorn, Kawatsu, Tsutomu, Oba, Yuki, Kungwan, Nawee, Tachikawa, Masanori

“…Heterodimer of formic acid and nitric acid, of which the monomer acidity has large difference, was studied by on-the-fly ab initio molecular dynamics (AIMD)…”
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Organocatalytic Ring-Opening Polymerization of ε -Caprolactone Using bis ( N -( N '-butylimidazolium)alkane Dicationic Ionic Liquids as the Metal-Free Catalysts: Polymer Synthesis, Kinetics and DFT Mechanistic Study by Cheechana, Nathaporn, Benchaphanthawee, Wachara, Akkravijitkul, Natthapol, Rithchumpon, Puracheth, Junpirom, Thiti, Limwanich, Wanich, Punyodom, Winita, Kungwan, Nawee, Ngaojampa, Chanisorn, Thavornyutikarn, Praput, Meepowpan, Puttinan

“…In this work, we successfully synthesized high thermal stable 1,n- ( -( '-butylimidazolium)alkane hexafluorophosphates (1,n- [Bim][PF ], n = 4, 6, 8, and 10)…”
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Molecular simulations of ultra-low-energy nitrogen ion bombardment of A-DNA in vacuum by Ngaojampa, Chanisorn, Nimmanpipug, Piyarat, Yu, Liangdeng, Anuntalabhochai, Somboon, Lee, Vannajan Sanghiran

“…For investigating mechanisms involved in low-energy ion beam induced mutation, besides experiments using low-energy and low-fluence ions to bombard naked DNA,…”
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A review of characterization of perovskite film in solar cells by spectroscopic ellipsometry by Li, Huihui, Cui, Changcai, Xu, Xipeng, Bian, Subiao, Ngaojampa, Chanisorn, Ruankham, Pipat, Jaroenjittchai, Atchara Punya

“…Perovskite materials have performed so excellently in semiconductor field due to their fascinating photoelectric properties. As solar cell absorber materials,…”
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Heteroatom effect on photophysical properties of 2-(2′-hydroxyphenyl)benzimidazole and its derivatives as fluorescent dyes: A TD-DFT study by Manojai, Natthaporn, Daengngern, Rathawat, Kerdpol, Khanittha, Ngaojampa, Chanisorn, Kungwan, Nawee

“…The effects of hetero nitrogen substitution on the photophysical properties and excited-state intramolecular proton transfer (ESIPT) of HBX derivatives (HBI,…”
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Monte carlo and molecular dynamics simulations of surface modification of DNA interacted with ultra-low-energy carbon atoms by Lee, Vannajan Sanghiran, Ngaojampa, Chanisorn, Nimmanpipug, Piyarat, Yu, Liangdeng

“…DNA surface and DNA strand breaks of 12 base pairs of alternating poly-AT double strands of DNA in A form were investigated by Monte Carlo simulations to find…”
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TD-DFT Study of Absorption and Emission Spectra of 2-(2′-Aminophenyl)benzothiazole Derivatives in Water by Manojai, Natthaporn, Daengngern, Rathawat, Kerdpol, Khanittha, Kungwan, Nawee, Ngaojampa, Chanisorn

“…Reduction of aromatic azides to amines is an important property of hydrogen sulphide (H 2 S) which is useful in fluorescence microscopy and H 2 S probing in…”
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Influence of phenyl-attached substituents on the vibrational and electronic spectra of meso-tetraphenylporphyrin: A DFT study by Ngaojampa, Chanisorn, Namuangruk, Supawadee, Surakhot, Yaowarat, Promarak, Vinich, Jungsuttiwong, Siriporn, Kungwan, Nawee

“…[Display omitted] •Vibrational and electronic spectra of eight phenyl-attached analogs of meso-tetraphenylporphyrin (H2TPP) were calculated.•Meso-phenyl…”
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