Monte Carlo methods in ab initio quantum chemistry:
Saved in:
| Main Author: | |
|---|---|
| Format: | Electronic eBook |
| Language: | English |
| Published: |
Singapore
World Scientific
c1994
|
| Series: | World scientific lecture and course notes in chemistry
v. 1 |
| Subjects: | |
| Online Access: | FAW01 FAW02 Volltext |
| Item Description: | Includes bibliographical references (p. 287-304) 1. Introduction to Monte Carlo Methods -- 2. Variational Methods -- 3. Green's Function Methods -- 4. Treating Fermions -- 5. Variational Trial Functions -- 6. Excited States -- 7. Electronic Properties -- 8. Derivatives and Finite Differences -- 9. Heavy Atoms -- A: Atomic Units -- B: Evaluating the Trial Function -- C: Sample Diffusion Monte Carlo Program |
| Physical Description: | 1 Online-Ressource (xiv, 304 p.) |
| ISBN: | 9789810203214 9789810203221 9789814317245 9810203217 9810203225 9814317241 |
Staff View
MARC
| LEADER | 00000nmm a2200000zcb4500 | ||
|---|---|---|---|
| 001 | BV043081118 | ||
| 003 | DE-604 | ||
| 005 | 00000000000000.0 | ||
| 007 | cr|uuu---uuuuu | ||
| 008 | 151126s1994 |||| o||u| ||||||eng d | ||
| 020 | |a 9789810203214 |9 978-981-02-0321-4 | ||
| 020 | |a 9789810203221 |9 978-981-02-0322-1 | ||
| 020 | |a 9789814317245 |c electronic bk. |9 978-981-4317-24-5 | ||
| 020 | |a 9810203217 |9 981-02-0321-7 | ||
| 020 | |a 9810203225 |9 981-02-0322-5 | ||
| 020 | |a 9814317241 |c electronic bk. |9 981-4317-24-1 | ||
| 035 | |a (OCoLC)842919972 | ||
| 035 | |a (DE-599)BVBBV043081118 | ||
| 040 | |a DE-604 |b ger |e aacr | ||
| 041 | 0 | |a eng | |
| 049 | |a DE-1046 |a DE-1047 | ||
| 082 | 0 | |a 541.2/8/01519282 |2 22 | |
| 100 | 1 | |a Hammond, B. L. |e Verfasser |4 aut | |
| 245 | 1 | 0 | |a Monte Carlo methods in ab initio quantum chemistry |c B.L. Hammond, W.A. Lester, Jr., P.J. Reynolds |
| 264 | 1 | |a Singapore |b World Scientific |c c1994 | |
| 300 | |a 1 Online-Ressource (xiv, 304 p.) | ||
| 336 | |b txt |2 rdacontent | ||
| 337 | |b c |2 rdamedia | ||
| 338 | |b cr |2 rdacarrier | ||
| 490 | 0 | |a World scientific lecture and course notes in chemistry |v v. 1 | |
| 500 | |a Includes bibliographical references (p. 287-304) | ||
| 500 | |a 1. Introduction to Monte Carlo Methods -- 2. Variational Methods -- 3. Green's Function Methods -- 4. Treating Fermions -- 5. Variational Trial Functions -- 6. Excited States -- 7. Electronic Properties -- 8. Derivatives and Finite Differences -- 9. Heavy Atoms -- A: Atomic Units -- B: Evaluating the Trial Function -- C: Sample Diffusion Monte Carlo Program | ||
| 650 | 7 | |a Chimie quantique |2 ram | |
| 650 | 7 | |a Monte-Carlo, Méthode de |2 ram | |
| 650 | 7 | |a Méthodes ab initio (chimie quantique) |2 ram | |
| 650 | 7 | |a Monte-Carlo-Simulation |2 swd | |
| 650 | 7 | |a Quantenchemie |2 swd | |
| 650 | 7 | |a SCIENCE / Chemistry / Physical & Theoretical |2 bisacsh | |
| 650 | 7 | |a Monte Carlo method |2 fast | |
| 650 | 7 | |a Quantum chemistry |2 fast | |
| 650 | 4 | |a Chemie | |
| 650 | 4 | |a Quantum chemistry | |
| 650 | 4 | |a Monte Carlo method | |
| 650 | 0 | 7 | |a Monte-Carlo-Simulation |0 (DE-588)4240945-7 |2 gnd |9 rswk-swf |
| 650 | 0 | 7 | |a Quantenchemie |0 (DE-588)4047979-1 |2 gnd |9 rswk-swf |
| 689 | 0 | 0 | |a Quantenchemie |0 (DE-588)4047979-1 |D s |
| 689 | 0 | 1 | |a Monte-Carlo-Simulation |0 (DE-588)4240945-7 |D s |
| 689 | 0 | |8 1\p |5 DE-604 | |
| 700 | 1 | |a Lester, W. A. |e Sonstige |4 oth | |
| 700 | 1 | |a Reynolds, Peter J. |e Sonstige |4 oth | |
| 856 | 4 | 0 | |u http://search.ebscohost.com/login.aspx?direct=true&scope=site&db=nlebk&db=nlabk&AN=564637 |x Aggregator |3 Volltext |
| 912 | |a ZDB-4-EBA | ||
| 999 | |a oai:aleph.bib-bvb.de:BVB01-028505309 | ||
| 883 | 1 | |8 1\p |a cgwrk |d 20201028 |q DE-101 |u https://d-nb.info/provenance/plan#cgwrk | |
| 966 | e | |u http://search.ebscohost.com/login.aspx?direct=true&scope=site&db=nlebk&db=nlabk&AN=564637 |l FAW01 |p ZDB-4-EBA |q FAW_PDA_EBA |x Aggregator |3 Volltext | |
| 966 | e | |u http://search.ebscohost.com/login.aspx?direct=true&scope=site&db=nlebk&db=nlabk&AN=564637 |l FAW02 |p ZDB-4-EBA |q FAW_PDA_EBA |x Aggregator |3 Volltext | |
Record in the Search Index
| _version_ | 1804175473469554688 |
|---|---|
| any_adam_object | |
| author | Hammond, B. L. |
| author_facet | Hammond, B. L. |
| author_role | aut |
| author_sort | Hammond, B. L. |
| author_variant | b l h bl blh |
| building | Verbundindex |
| bvnumber | BV043081118 |
| collection | ZDB-4-EBA |
| ctrlnum | (OCoLC)842919972 (DE-599)BVBBV043081118 |
| dewey-full | 541.2/8/01519282 |
| dewey-hundreds | 500 - Natural sciences and mathematics |
| dewey-ones | 541 - Physical chemistry |
| dewey-raw | 541.2/8/01519282 |
| dewey-search | 541.2/8/01519282 |
| dewey-sort | 3541.2 18 71519282 |
| dewey-tens | 540 - Chemistry and allied sciences |
| discipline | Chemie / Pharmazie |
| format | Electronic eBook |
| fullrecord | <?xml version="1.0" encoding="UTF-8"?><collection xmlns="http://www.loc.gov/MARC21/slim"><record><leader>02999nmm a2200637zcb4500</leader><controlfield tag="001">BV043081118</controlfield><controlfield tag="003">DE-604</controlfield><controlfield tag="005">00000000000000.0</controlfield><controlfield tag="007">cr|uuu---uuuuu</controlfield><controlfield tag="008">151126s1994 |||| o||u| ||||||eng d</controlfield><datafield tag="020" ind1=" " ind2=" "><subfield code="a">9789810203214</subfield><subfield code="9">978-981-02-0321-4</subfield></datafield><datafield tag="020" ind1=" " ind2=" "><subfield code="a">9789810203221</subfield><subfield code="9">978-981-02-0322-1</subfield></datafield><datafield tag="020" ind1=" " ind2=" "><subfield code="a">9789814317245</subfield><subfield code="c">electronic bk.</subfield><subfield code="9">978-981-4317-24-5</subfield></datafield><datafield tag="020" ind1=" " ind2=" "><subfield code="a">9810203217</subfield><subfield code="9">981-02-0321-7</subfield></datafield><datafield tag="020" ind1=" " ind2=" "><subfield code="a">9810203225</subfield><subfield code="9">981-02-0322-5</subfield></datafield><datafield tag="020" ind1=" " ind2=" "><subfield code="a">9814317241</subfield><subfield code="c">electronic bk.</subfield><subfield code="9">981-4317-24-1</subfield></datafield><datafield tag="035" ind1=" " ind2=" "><subfield code="a">(OCoLC)842919972</subfield></datafield><datafield tag="035" ind1=" " ind2=" "><subfield code="a">(DE-599)BVBBV043081118</subfield></datafield><datafield tag="040" ind1=" " ind2=" "><subfield code="a">DE-604</subfield><subfield code="b">ger</subfield><subfield code="e">aacr</subfield></datafield><datafield tag="041" ind1="0" ind2=" "><subfield code="a">eng</subfield></datafield><datafield tag="049" ind1=" " ind2=" "><subfield code="a">DE-1046</subfield><subfield code="a">DE-1047</subfield></datafield><datafield tag="082" ind1="0" ind2=" "><subfield code="a">541.2/8/01519282</subfield><subfield code="2">22</subfield></datafield><datafield tag="100" ind1="1" ind2=" "><subfield code="a">Hammond, B. L.</subfield><subfield code="e">Verfasser</subfield><subfield code="4">aut</subfield></datafield><datafield tag="245" ind1="1" ind2="0"><subfield code="a">Monte Carlo methods in ab initio quantum chemistry</subfield><subfield code="c">B.L. Hammond, W.A. Lester, Jr., P.J. Reynolds</subfield></datafield><datafield tag="264" ind1=" " ind2="1"><subfield code="a">Singapore</subfield><subfield code="b">World Scientific</subfield><subfield code="c">c1994</subfield></datafield><datafield tag="300" ind1=" " ind2=" "><subfield code="a">1 Online-Ressource (xiv, 304 p.)</subfield></datafield><datafield tag="336" ind1=" " ind2=" "><subfield code="b">txt</subfield><subfield code="2">rdacontent</subfield></datafield><datafield tag="337" ind1=" " ind2=" "><subfield code="b">c</subfield><subfield code="2">rdamedia</subfield></datafield><datafield tag="338" ind1=" " ind2=" "><subfield code="b">cr</subfield><subfield code="2">rdacarrier</subfield></datafield><datafield tag="490" ind1="0" ind2=" "><subfield code="a">World scientific lecture and course notes in chemistry</subfield><subfield code="v">v. 1</subfield></datafield><datafield tag="500" ind1=" " ind2=" "><subfield code="a">Includes bibliographical references (p. 287-304)</subfield></datafield><datafield tag="500" ind1=" " ind2=" "><subfield code="a">1. Introduction to Monte Carlo Methods -- 2. Variational Methods -- 3. Green's Function Methods -- 4. Treating Fermions -- 5. Variational Trial Functions -- 6. Excited States -- 7. Electronic Properties -- 8. Derivatives and Finite Differences -- 9. Heavy Atoms -- A: Atomic Units -- B: Evaluating the Trial Function -- C: Sample Diffusion Monte Carlo Program</subfield></datafield><datafield tag="650" ind1=" " ind2="7"><subfield code="a">Chimie quantique</subfield><subfield code="2">ram</subfield></datafield><datafield tag="650" ind1=" " ind2="7"><subfield code="a">Monte-Carlo, Méthode de</subfield><subfield code="2">ram</subfield></datafield><datafield tag="650" ind1=" " ind2="7"><subfield code="a">Méthodes ab initio (chimie quantique)</subfield><subfield code="2">ram</subfield></datafield><datafield tag="650" ind1=" " ind2="7"><subfield code="a">Monte-Carlo-Simulation</subfield><subfield code="2">swd</subfield></datafield><datafield tag="650" ind1=" " ind2="7"><subfield code="a">Quantenchemie</subfield><subfield code="2">swd</subfield></datafield><datafield tag="650" ind1=" " ind2="7"><subfield code="a">SCIENCE / Chemistry / Physical & Theoretical</subfield><subfield code="2">bisacsh</subfield></datafield><datafield tag="650" ind1=" " ind2="7"><subfield code="a">Monte Carlo method</subfield><subfield code="2">fast</subfield></datafield><datafield tag="650" ind1=" " ind2="7"><subfield code="a">Quantum chemistry</subfield><subfield code="2">fast</subfield></datafield><datafield tag="650" ind1=" " ind2="4"><subfield code="a">Chemie</subfield></datafield><datafield tag="650" ind1=" " ind2="4"><subfield code="a">Quantum chemistry</subfield></datafield><datafield tag="650" ind1=" " ind2="4"><subfield code="a">Monte Carlo method</subfield></datafield><datafield tag="650" ind1="0" ind2="7"><subfield code="a">Monte-Carlo-Simulation</subfield><subfield code="0">(DE-588)4240945-7</subfield><subfield code="2">gnd</subfield><subfield code="9">rswk-swf</subfield></datafield><datafield tag="650" ind1="0" ind2="7"><subfield code="a">Quantenchemie</subfield><subfield code="0">(DE-588)4047979-1</subfield><subfield code="2">gnd</subfield><subfield code="9">rswk-swf</subfield></datafield><datafield tag="689" ind1="0" ind2="0"><subfield code="a">Quantenchemie</subfield><subfield code="0">(DE-588)4047979-1</subfield><subfield code="D">s</subfield></datafield><datafield tag="689" ind1="0" ind2="1"><subfield code="a">Monte-Carlo-Simulation</subfield><subfield code="0">(DE-588)4240945-7</subfield><subfield code="D">s</subfield></datafield><datafield tag="689" ind1="0" ind2=" "><subfield code="8">1\p</subfield><subfield code="5">DE-604</subfield></datafield><datafield tag="700" ind1="1" ind2=" "><subfield code="a">Lester, W. A.</subfield><subfield code="e">Sonstige</subfield><subfield code="4">oth</subfield></datafield><datafield tag="700" ind1="1" ind2=" "><subfield code="a">Reynolds, Peter J.</subfield><subfield code="e">Sonstige</subfield><subfield code="4">oth</subfield></datafield><datafield tag="856" ind1="4" ind2="0"><subfield code="u">http://search.ebscohost.com/login.aspx?direct=true&scope=site&db=nlebk&db=nlabk&AN=564637</subfield><subfield code="x">Aggregator</subfield><subfield code="3">Volltext</subfield></datafield><datafield tag="912" ind1=" " ind2=" "><subfield code="a">ZDB-4-EBA</subfield></datafield><datafield tag="999" ind1=" " ind2=" "><subfield code="a">oai:aleph.bib-bvb.de:BVB01-028505309</subfield></datafield><datafield tag="883" ind1="1" ind2=" "><subfield code="8">1\p</subfield><subfield code="a">cgwrk</subfield><subfield code="d">20201028</subfield><subfield code="q">DE-101</subfield><subfield code="u">https://d-nb.info/provenance/plan#cgwrk</subfield></datafield><datafield tag="966" ind1="e" ind2=" "><subfield code="u">http://search.ebscohost.com/login.aspx?direct=true&scope=site&db=nlebk&db=nlabk&AN=564637</subfield><subfield code="l">FAW01</subfield><subfield code="p">ZDB-4-EBA</subfield><subfield code="q">FAW_PDA_EBA</subfield><subfield code="x">Aggregator</subfield><subfield code="3">Volltext</subfield></datafield><datafield tag="966" ind1="e" ind2=" "><subfield code="u">http://search.ebscohost.com/login.aspx?direct=true&scope=site&db=nlebk&db=nlabk&AN=564637</subfield><subfield code="l">FAW02</subfield><subfield code="p">ZDB-4-EBA</subfield><subfield code="q">FAW_PDA_EBA</subfield><subfield code="x">Aggregator</subfield><subfield code="3">Volltext</subfield></datafield></record></collection> |
| id | DE-604.BV043081118 |
| illustrated | Not Illustrated |
| indexdate | 2024-07-10T07:16:51Z |
| institution | BVB |
| isbn | 9789810203214 9789810203221 9789814317245 9810203217 9810203225 9814317241 |
| language | English |
| oai_aleph_id | oai:aleph.bib-bvb.de:BVB01-028505309 |
| oclc_num | 842919972 |
| open_access_boolean | |
| owner | DE-1046 DE-1047 |
| owner_facet | DE-1046 DE-1047 |
| physical | 1 Online-Ressource (xiv, 304 p.) |
| psigel | ZDB-4-EBA ZDB-4-EBA FAW_PDA_EBA |
| publishDate | 1994 |
| publishDateSearch | 1994 |
| publishDateSort | 1994 |
| publisher | World Scientific |
| record_format | marc |
| series2 | World scientific lecture and course notes in chemistry |
| spelling | Hammond, B. L. Verfasser aut Monte Carlo methods in ab initio quantum chemistry B.L. Hammond, W.A. Lester, Jr., P.J. Reynolds Singapore World Scientific c1994 1 Online-Ressource (xiv, 304 p.) txt rdacontent c rdamedia cr rdacarrier World scientific lecture and course notes in chemistry v. 1 Includes bibliographical references (p. 287-304) 1. Introduction to Monte Carlo Methods -- 2. Variational Methods -- 3. Green's Function Methods -- 4. Treating Fermions -- 5. Variational Trial Functions -- 6. Excited States -- 7. Electronic Properties -- 8. Derivatives and Finite Differences -- 9. Heavy Atoms -- A: Atomic Units -- B: Evaluating the Trial Function -- C: Sample Diffusion Monte Carlo Program Chimie quantique ram Monte-Carlo, Méthode de ram Méthodes ab initio (chimie quantique) ram Monte-Carlo-Simulation swd Quantenchemie swd SCIENCE / Chemistry / Physical & Theoretical bisacsh Monte Carlo method fast Quantum chemistry fast Chemie Quantum chemistry Monte Carlo method Monte-Carlo-Simulation (DE-588)4240945-7 gnd rswk-swf Quantenchemie (DE-588)4047979-1 gnd rswk-swf Quantenchemie (DE-588)4047979-1 s Monte-Carlo-Simulation (DE-588)4240945-7 s 1\p DE-604 Lester, W. A. Sonstige oth Reynolds, Peter J. Sonstige oth http://search.ebscohost.com/login.aspx?direct=true&scope=site&db=nlebk&db=nlabk&AN=564637 Aggregator Volltext 1\p cgwrk 20201028 DE-101 https://d-nb.info/provenance/plan#cgwrk |
| spellingShingle | Hammond, B. L. Monte Carlo methods in ab initio quantum chemistry Chimie quantique ram Monte-Carlo, Méthode de ram Méthodes ab initio (chimie quantique) ram Monte-Carlo-Simulation swd Quantenchemie swd SCIENCE / Chemistry / Physical & Theoretical bisacsh Monte Carlo method fast Quantum chemistry fast Chemie Quantum chemistry Monte Carlo method Monte-Carlo-Simulation (DE-588)4240945-7 gnd Quantenchemie (DE-588)4047979-1 gnd |
| subject_GND | (DE-588)4240945-7 (DE-588)4047979-1 |
| title | Monte Carlo methods in ab initio quantum chemistry |
| title_auth | Monte Carlo methods in ab initio quantum chemistry |
| title_exact_search | Monte Carlo methods in ab initio quantum chemistry |
| title_full | Monte Carlo methods in ab initio quantum chemistry B.L. Hammond, W.A. Lester, Jr., P.J. Reynolds |
| title_fullStr | Monte Carlo methods in ab initio quantum chemistry B.L. Hammond, W.A. Lester, Jr., P.J. Reynolds |
| title_full_unstemmed | Monte Carlo methods in ab initio quantum chemistry B.L. Hammond, W.A. Lester, Jr., P.J. Reynolds |
| title_short | Monte Carlo methods in ab initio quantum chemistry |
| title_sort | monte carlo methods in ab initio quantum chemistry |
| topic | Chimie quantique ram Monte-Carlo, Méthode de ram Méthodes ab initio (chimie quantique) ram Monte-Carlo-Simulation swd Quantenchemie swd SCIENCE / Chemistry / Physical & Theoretical bisacsh Monte Carlo method fast Quantum chemistry fast Chemie Quantum chemistry Monte Carlo method Monte-Carlo-Simulation (DE-588)4240945-7 gnd Quantenchemie (DE-588)4047979-1 gnd |
| topic_facet | Chimie quantique Monte-Carlo, Méthode de Méthodes ab initio (chimie quantique) Monte-Carlo-Simulation Quantenchemie SCIENCE / Chemistry / Physical & Theoretical Monte Carlo method Quantum chemistry Chemie |
| url | http://search.ebscohost.com/login.aspx?direct=true&scope=site&db=nlebk&db=nlabk&AN=564637 |
| work_keys_str_mv | AT hammondbl montecarlomethodsinabinitioquantumchemistry AT lesterwa montecarlomethodsinabinitioquantumchemistry AT reynoldspeterj montecarlomethodsinabinitioquantumchemistry |