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SCEJ 85th Annual Meeting (2020)

Last modified: 2020-03-02 11:00:00

Program search result : 推算法 : 2 programs

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Title (J) field includes “推算法”; 2 programs are found.
The search results are sorted by the start time.

TimePaper
ID		Title / AuthorsKeywordsTopic codeAck.
number
Day 3
9:00– 9:20		J301Estimation of thermodynamic data for aqueous species using QM/CSMs.
(Yokohama Nat. U.) *(Reg)Izato Yuichiro, (AIST) Matsugi Akira, (JST-LCS) Koshi Mitsuo, (Yokohama Nat. U.) (Reg)Miyake Atsumi
Themochemical data
Quantum chemistry calculation
Continiuum solvation model
1-a465
Day 3
14:05– 14:55		A307[Requested talk] Prediction method of binary diffusion coefficients of solutes using molecular volume obtained from quantum chemical calculation
(Chuo U.) *(Reg)Sakabe Junichi, (Reg)Funazukuri Toshitaka
molecular volume
diffusion coefficients
quantum chemical calculation
HQ-21686

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SCEJ 85th Annual Meeting (2020)

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