Molecular Dynamics Simulation / / Multidisciplinary Digital Publishing Institute.
Condensed matter systems, ranging from simple fluids and solids to complex multicomponent materials and even biological matter, are governed by well understood laws of physics, within the formal theoretical framework of quantum theory and statistical mechanics. On the relevant scales of length and t...
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| Place / Publishing House: | [Place of publication not identified] : : MDPI - Multidisciplinary Digital Publishing Institute,, 2014. |
| Year of Publication: | 2014 |
| Language: | English |
| Physical Description: | 1 online resource (628 pages) |
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Multidisciplinary Digital Publishing Institute, author, issuing body. Molecular Dynamics Simulation / Multidisciplinary Digital Publishing Institute. [Place of publication not identified] : MDPI - Multidisciplinary Digital Publishing Institute, 2014. 1 online resource (628 pages) text txt rdacontent computer c rdamedia online resource cr rdacarrier Description based on online resource; title from PDF title page (MDPI - Multidisciplinary Digital Publishing Institute, viewed March 28, 2023). Condensed matter systems, ranging from simple fluids and solids to complex multicomponent materials and even biological matter, are governed by well understood laws of physics, within the formal theoretical framework of quantum theory and statistical mechanics. On the relevant scales of length and time, the appropriate 'first-principles' description needs only the Schroedinger equation together with Gibbs averaging over the relevant statistical ensemble. However, this program cannot be carried out straightforwardly-dealing with electron correlations is still a challenge for the methods of quantum chemistry. Similarly, standard statistical mechanics makes precise explicit statements only on the properties of systems for which the many-body problem can be effectively reduced to one of independent particles or quasi-particles. Digital computer simulation. 3-906980-66-9 |
| language |
English |
| format |
eBook |
| author_corporate |
Multidisciplinary Digital Publishing Institute, |
| author_facet |
Multidisciplinary Digital Publishing Institute, |
| author_corporate_role |
VerfasserIn |
| author_sort |
Multidisciplinary Digital Publishing Institute, |
| title |
Molecular Dynamics Simulation / |
| spellingShingle |
Molecular Dynamics Simulation / |
| title_full |
Molecular Dynamics Simulation / Multidisciplinary Digital Publishing Institute. |
| title_fullStr |
Molecular Dynamics Simulation / Multidisciplinary Digital Publishing Institute. |
| title_full_unstemmed |
Molecular Dynamics Simulation / Multidisciplinary Digital Publishing Institute. |
| title_auth |
Molecular Dynamics Simulation / |
| title_new |
Molecular Dynamics Simulation / |
| title_sort |
molecular dynamics simulation / |
| publisher |
MDPI - Multidisciplinary Digital Publishing Institute, |
| publishDate |
2014 |
| physical |
1 online resource (628 pages) |
| isbn |
3-906980-66-9 |
| callnumber-first |
Q - Science |
| callnumber-subject |
QA - Mathematics |
| callnumber-label |
QA76 |
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QA 276.9 C65 M858 42014 |
| illustrated |
Not Illustrated |
| dewey-hundreds |
000 - Computer science, information & general works |
| dewey-tens |
000 - Computer science, knowledge & systems |
| dewey-ones |
001 - Knowledge |
| dewey-full |
001.434 |
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11.434 |
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001.434 |
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001.434 |
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AT multidisciplinarydigitalpublishinginstitute moleculardynamicssimulation |
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(CKB)4920000001372838 (NjHacI)994920000001372838 (EXLCZ)994920000001372838 |
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Molecular Dynamics Simulation / |
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1764992091039989760 |
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