Theoretical and computational chemistry

• 資料種別: 図書
• タイトル: Theoretical and computational chemistry
• 出版事項: Elsevier
• 出版地（国名コード）: ne
• 対象利用者: 一般
• 関連情報: Molecular dynamics : from classical to quantum methods; https://cir.nii.ac.jp/crid/1130000794273376000; Recent developments and applications of modern density functional theory; https://cir.nii.ac.jp/crid/1130000794892655104; Modern density functional theory : a tool for chemistry; https://cir.nii.ac.jp/crid/1130000795392525312; Quantitative treatments of solute/solvent interactions; https://cir.nii.ac.jp/crid/1130000795687447296; Theoretical biochemistry : processes and properties of biological systems; https://cir.nii.ac.jp/crid/1130000796410524032; Molecular electrostatic potentials : concepts and applications; https://cir.nii.ac.jp/crid/1130000797472318336; Pauling's legacy : modern modelling of the chemical bond; https://cir.nii.ac.jp/crid/1130282268708873600; Detonation, combustion; https://cir.nii.ac.jp/crid/1130282268869813376; Computational photochemistry; https://cir.nii.ac.jp/crid/1130282268892343040; Molecular and nano electronics : analysis, design and simulation; https://cir.nii.ac.jp/crid/1130282269262575744; Relativistic electronic structure theory; https://cir.nii.ac.jp/crid/1130282270274353664; Decomposition, crystal, and molecular properties; https://cir.nii.ac.jp/crid/1130282270486981760; Computational materials science; https://cir.nii.ac.jp/crid/1130282270974808448; Computational molecular biology; https://cir.nii.ac.jp/crid/1130282271176045184; Valence bond theory; https://cir.nii.ac.jp/crid/1130282271201702016; Theoretical organic chemistry; https://cir.nii.ac.jp/crid/1130282271731227648; Theoretical aspects of chemical reactivity; https://cir.nii.ac.jp/crid/1130282271778596352; Nanomaterials : design and simulation; https://cir.nii.ac.jp/crid/1130282272860363136; Molecular modeling of the sensitivities of energetic materials; https://cir.nii.ac.jp/crid/1130292152023556362; Properties and functionalization of graphene : a computational chemistry approach; https://cir.nii.ac.jp/crid/1130292461097219731; The crystalline states of organic compounds; https://cir.nii.ac.jp/crid/1130854029878911371
• 関連情報（URI）: https://ci.nii.ac.jp/ncid/BA23996819#entity
• 連携機関・データベース: 国立情報学研究所 : CiNii Research
• 提供元機関・データベース: CiNii Books; https://ci.nii.ac.jp/books
• NACSIS書誌ID（NCID）: https://ci.nii.ac.jp/ncid/BA23996819 : BA23996819

目次

Molecular dynamics : from classical to quantum methods

Recent developments and applications of modern density functional theory

Modern density functional theory : a tool for chemistry

Quantitative treatments of solute/solvent interactions

Theoretical biochemistry : processes and properties of biological systems