國立虎尾科技大學 |

Foundations of Molecular Modeling and Simulation = Select Papers from FOMMS 2018 /

紀錄類型:	書目-語言資料,印刷品 : Monograph/item
正題名/作者:	Foundations of Molecular Modeling and Simulation/ edited by Edward J. Maginn, Jeffrey Errington.
其他題名:	Select Papers from FOMMS 2018 /
其他作者:	Errington, Jeffrey.
面頁冊數:	X, 220 p. 87 illus., 84 illus. in color.online resource. :
Contained By:	Springer Nature eBook
標題:	Industrial Chemistry/Chemical Engineering. -
電子資源:	https://doi.org/10.1007/978-981-33-6639-8
ISBN:	9789813366398

Foundations of Molecular Modeling and Simulation = Select Papers from FOMMS 2018 /
Foundations of Molecular Modeling and SimulationSelect Papers from FOMMS 2018 /[electronic resource] :edited by Edward J. Maginn, Jeffrey Errington. - 1st ed. 2021. - X, 220 p. 87 illus., 84 illus. in color.online resource. - Molecular Modeling and Simulation, Applications and Perspectives,2364-5083. - Molecular Modeling and Simulation, Applications and Perspectives,.

Strain Controlling Catalytic Efficiency of Water Oxidation for Ni1-xFexOOH alloy -- The Role of Entropy in the Structural Transitions in Zeolitic Imidazolate Frameworks -- Coarse-grained modeling and simulations of thermoresponsive biopolymers and polymer nanocomposites with specific and directional interactions -- Dissipative Particle Dynamics Approaches to Modeling the Self-Assembly and Morphology of Neutral and Ionic Block Copolymers in Solution -- The Statistical Mechanics of Solution-phase Nucleation: CaCO3 Revisited -- Efficient Sampling of High-Dimensional Free Energy Landscapes: A Review of Parallel Bias Metadynamics.

This highly informative and carefully presented book comprises select proceedings of Foundation for Molecular Modelling and Simulation (FOMMS 2018). The contents are written by invited speakers centered on the theme Innovation for Complex Systems. It showcases new developments and applications of computational quantum chemistry, statistical mechanics, molecular simulation and theory, and continuum and engineering process simulation. This volume will serve as a useful reference to researchers, academicians and practitioners alike.

ISBN: 9789813366398

Standard No.: 10.1007/978-981-33-6639-8doiSubjects--Topical Terms:

671153
Industrial Chemistry/Chemical Engineering.

LC Class. No.: QD450-801

Dewey Class. No.: 541.2

Foundations of Molecular Modeling and Simulation = Select Papers from FOMMS 2018 /
LDR:02676nam a22004095i 4500 001 1045693
003 DE-He213
005 20210622173652.0
007 cr nn 008mamaa
008 220103s2021 si | s |||| 0|eng d
020 $a 9789813366398 $9 978-981-33-6639-8
024 7 $a 10.1007/978-981-33-6639-8 $2 doi
035 $a 978-981-33-6639-8
050 4 $a QD450-801
072 7 $a PNRP $2 bicssc
072 7 $a SCI013050 $2 bisacsh
072 7 $a PNRP $2 thema
082 0 4 $a 541.2 $2 23
245 1 0 $a Foundations of Molecular Modeling and Simulation $h [electronic resource] : $b Select Papers from FOMMS 2018 / $c edited by Edward J. Maginn, Jeffrey Errington.
250 $a 1st ed. 2021.
264 1 $a Singapore : $b Springer Singapore : $b Imprint: Springer, $c 2021.
300 $a X, 220 p. 87 illus., 84 illus. in color. $b online resource.
336 $a text $b txt $2 rdacontent
337 $a computer $b c $2 rdamedia
338 $a online resource $b cr $2 rdacarrier
347 $a text file $b PDF $2 rda
490 1 $a Molecular Modeling and Simulation, Applications and Perspectives, $x 2364-5083
505 0 $a Strain Controlling Catalytic Efficiency of Water Oxidation for Ni1-xFexOOH alloy -- The Role of Entropy in the Structural Transitions in Zeolitic Imidazolate Frameworks -- Coarse-grained modeling and simulations of thermoresponsive biopolymers and polymer nanocomposites with specific and directional interactions -- Dissipative Particle Dynamics Approaches to Modeling the Self-Assembly and Morphology of Neutral and Ionic Block Copolymers in Solution -- The Statistical Mechanics of Solution-phase Nucleation: CaCO3 Revisited -- Efficient Sampling of High-Dimensional Free Energy Landscapes: A Review of Parallel Bias Metadynamics.
520 $a This highly informative and carefully presented book comprises select proceedings of Foundation for Molecular Modelling and Simulation (FOMMS 2018). The contents are written by invited speakers centered on the theme Innovation for Complex Systems. It showcases new developments and applications of computational quantum chemistry, statistical mechanics, molecular simulation and theory, and continuum and engineering process simulation. This volume will serve as a useful reference to researchers, academicians and practitioners alike.
650 2 4 $a Industrial Chemistry/Chemical Engineering. $3 671153
650 2 4 $a Life Sciences, general. $3 668532
650 1 4 $a Theoretical and Computational Chemistry. $3 670313
650 0 $a Chemical engineering. $3 555952
650 0 $a Life sciences. $3 815602
650 0 $a Chemistry, Physical and theoretical. $3 557299
700 1 $a Errington, Jeffrey. $e editor. $4 edt $4 http://id.loc.gov/vocabulary/relators/edt $3 1349110
700 1 $a Maginn, Edward J. $e editor. $4 edt $4 http://id.loc.gov/vocabulary/relators/edt $3 1349109
710 2 $a SpringerLink (Online service) $3 593884
773 0 $t Springer Nature eBook
776 0 8 $i Printed edition: $z 9789813366381
776 0 8 $i Printed edition: $z 9789813366404
776 0 8 $i Printed edition: $z 9789813366411
830 0 $a Molecular Modeling and Simulation, Applications and Perspectives, $x 2364-5083 $3 1266517
856 4 0 $u https://doi.org/10.1007/978-981-33-6639-8
912 $a ZDB-2-CMS
912 $a ZDB-2-SXC
950 $a Chemistry and Materials Science (SpringerNature-11644)
950 $a Chemistry and Material Science (R0) (SpringerNature-43709)