cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.25549/examiner-c44-76059
title: Finn Twins hearing, 1954

description: 5 images. Finn Twins hearing, 14 July 1954. Henry Cohen; Patricia Lynn; Bernard Cohen.; Caption slip reads: "Photographer: Hecht. Date: 1954-07-14. Reporter: Devlin. Assignment: Finn Hearing. l. to r., 28/29/39: Henry Cohen, Patricia Lynn and Bernard Cohen. 11: Patricia Lynn and Henry Cohen. 38: Patricia Lynn and Bernard Cohen. Henry Cohen is the older man of both Cohens".
DOI: 10.25549/examiner-c44-65974
title: Bigamist, 1957

description: 4 images. Bigamist, 8 November 1957. Norma Joyce -- 29 years (wife Number 2); Geneva Arnold Joyce (wife number 3); Dennis Joyce (Boy Bigamist).; Caption slip reads: "Photographer: Glickman. Assignment: Bigamy -- Dennis Joyce. G300: Norma Joyce, 29 and wife number 2 poses for picture. G301: Geneva Arnold Joyce, 33, and wife number 3, dark glasses. G111-112: Det. Sgt. Lou Belle and both wifes [sic], Norma in dark glasses and Geneva with black hood over head. G200/201: Dennis Joyce, boy bigamist".
DOI: 10.25549/examiner-c44-66733
title: Grandmothers convention, 1957

description: 3 images. Grandmothers convention, 13 October 1957. Ruth Serne (National Treasurer); Florence Newhall (National Second Vice President); Sylvia Stalcup (National President).; Caption slip reads: "Photographer: Lapp. Date: 1957-10-13. Reporter: Thackrey. Assignment: Grandmothers. 1/2: Ruth Serne, national treasurer of National Federation of Grandmothers Clubs. 13/14: Florence Newhall, national second vice president. 25/26: Mrs. Sylvia Stalcup, national president".
DOI: 10.15468/dl.c9tc4g
title: Occurrence Download

description: A dataset containing 46 species occurrences available in GBIF matching the query:
{
 "and" : [
 "BasisOfRecord is Specimen",
 "Country is one of (Tanzania, United Republic of, India, Timor-Leste, South Africa, Cook Islands)",
 "HasCoordinate is true",
 "HasGeospatialIssue is false",
 "TaxonKey is one of (Cascabela thevetia (L.) Lippold, Thevetia peruviana (Pers.) K.Schum.)"
 ]
}

 The dataset includes 46 records from 10 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0018444-240506114902167/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.25549/examiner-c44-11014
title: McFarling inquest, 1951

description: 9 images. McFarling inquest, 1 August 1951. Roger G. Webster; Mrs. Dixie Webster; Fred Daniel Webster.
DOI: 10.25549/examiner-c44-65904
title: Union Hall dedication, 1957

description: 2 images. Union Hall dedication, 10 November 1957. Charles Biolitti; Walter Reuther; J.R. Hurst.; Caption slip reads: "Photographer: Lapp. Date: 1957-11-10. Reporter: Thackrey. Assignment: Union Hall Dedication. 19: 3 shot - left to right - Charles Biolitti, Director of Western Region 6, UAW; Walter Reuther, President, UAW; J.R. Hurst, President UAW Local 887. 43/44: Walter Reuther, Pres. of UAW".
DOI: 10.25549/examiner-c44-103511
title: Loyola University Annual War Memorial, 1952

description: 4 images. Loyola University Annual War Memorial, 20 November 1952. 900 students at mass for departed dead.; Supplementary material reads: "Pix shows some 900 ROTC students at Loyola Univ. attending the annual war memorial mass for departed dead of student body, alumni & faculty- pix from balcony of symposium".
DOI: 10.15468/aspv89
title: PELD - MG | Biodiversidade e Biogeografia de Comunidades Bacterianas do parque Estadual do Rio Doce (MG)

description: Este recurso contém os dados do projeto de Biodiversidade e Biogeografia de Comunidades Bacterianas do parque Estadual do Rio Doce (MG), localizado na área do trecho médio da Bacia do Rio Doce, em Minas Gerais, Brasil. Compila todos os dados obtidos desde 2007 até 2011, tanto genéticos, quanto geográficos e ambientais.
DOI: 10.25549/examiner-c44-103452
title: Feeding animals at Griffith Park Zoo, 1957

description: 15 images. Feeding animals at Griffith Park Zoo, 11 October 1957. Bert Smith (chef at Griffith Park Zoo); Chimps "Sally" and "Gus"; Roger Bearanchi (keeper); George Ray (keeper); "Joyce" and "Bojo" elephant sister act; Bob Burt (keeper); Nilgai (Indian antelope); Van Yrineo (acting head keeper); "Boots" mountain lioness; "Dewline" polar bear.; Caption slip reads: "Photographer: Olmo. Date: 1957-10-11. Reporter: Donoghue. Assignment: Feeding at zoo. Special instructions: Monday feature. 13: Bert Smith, chef at the Griffith Park zoo, weighing 'lion's share' of horsemeat for king of jungle's lunch. Lions and tigers get between 14 and 15 pounds of meat a day, per animal. 14: Bert Smith, chef at the Griffith Park zoo, cutting filets [sic] of horsemeat for the smaller carnivora. Meat eaters at zoo consume more than 4100 pounds of meat a week. 17: Chimps at Griffith park zoo offer a challenge to head chef Bert Smith shown here as he cooks up animal-land version of a mulligan stew for the playful apes. 15/16: Bert Smith prepares fruit salad consisting of bananas, cantaloupe, grapes, raisins, apples, oranges, lettuce etc. for apes, etc. 18/22: Head chef Bert Smith looks while Acting Head Keeper Van Yrineo feeds cantaloupe to 'Dewline,' 8-month polar bear at Griffith Park zoo. 'Dewline,' a fish and meat eater, developed taste for melon from neighbor, 'Boots,' a melon-eating mountain lioness. 19/20: Acting Head Keeper Van Yrineo feeds cantaloupe to Boots, five year old mountain lioness at Griffith Park zoo. Usually the big cats eat nothing but meat, so the fact of a mountain lion (same family as panther, cougar, etc) eating melon for dessert is a rarity. Head Chef Bert Smith looks on".; Caption slip continues: "Photographer: Olmo....23/24: Chimps (Sally on bottom, Gus tp) are careless about table manners as Keeper Roger Bearanchi feeds them a choice fresh fruit plate of grapes, bananas, apple, melon and apples. 27/28: Keeper George Ray feeds carrots to Joyce, 6, and Bojo, 5, elephant 'sister act' at Griffith Park zoo. They also get hay, grain, fruit and bread. The pair beg like puppies for dainties. 29/30: Keeper Bob Burt bottle nurses month-old Nilgai (Indian antelope) fawn at Griffith Park Zoo. The baby, nicknamed Kip (short for Kipling), takes quart of goat's milk each nursing".
DOI: 10.25549/examiner-c44-103091
title: All Night Dance For Graduates (Long Beach Municipal Auditorium), 1954

description: 7 images. All Night Dance For Graduates (Long Beach Municipal Auditorium), 18 June 1954. Tommy Dorsey - & his orchestra; Arnold Webster; Margaret Guinn; Ginger Welshans; Norman Fore; Joy Haroldson; Marilyn Nash; Bobbe Bristow; Joyce Van Every; Diana Daniels; George Hawthorne; Robert Johnson (host); Jerry Tyhurst; Marty Harris; Richard Meadows; Cynthia Jonkman; George Sattler.; Caption slip reads: "Photographer: Emery. Date: 1954-06-18. Reporter: Emery to RW. Assignment: All night dance for graduates Long Beach Munic. Aud. 34: At 4am Cynthia Jonkman, 18, Jordan High grad, gets spun dizzily by partner George Sattler, 18, of Lakewood, in 'The New Yorker.' 23: After the all-night dance came breakfast. Girls did the cooking at the one, at 4802 Graywood Ave, Lakewood, & served it tot heir dates. About to scramble eggs, left to right, Diana Daniels, Marilyn Nash and Joy Henderson, all three Wilson High grads, and Bobbe Bristow, Poly High grad."
DOI: 10.25549/examiner-c44-20644
title: Traffic engineering meeting, 1951

description: 4 images. Traffic engineering meeting, 24 September 1951. Burton W. Marsh, Director Traffic Engineering and Safety of American Automobile Association; Harry E. Neal, President of Institute of Traffic Engineers; Nathan Cherniak, Vice President of Institute of Traffic Engineers.
DOI: 10.25549/examiner-c44-64435
title: Autos -- races -- Pomona sports cars, 1958

description: 30 images. Autos -- races -- Pomona sports cars, 9 February 1958. "Sports". (Sleeve reads: SP 12289).; Caption slip reads: "Photographer: Monteverde. Date: 1958-02-09. Assignment: Sports car races; Pomona. 35 mm: Sports car races. 2 rolls".
DOI: 10.25549/examiner-c44-70254
title: Zuma Beach, Long Beach Golf Course and L.A. Marina (Dominguez Dump), 1961

description: 16 images. Zuma Beach, Long Beach Golf Course and L.A. Marina (Dominguez Dump), 09 August 1961. South of paved parking area; Zuma Beach; General Views; Dominguez rubbish dump.; Caption slip reads: "Photographer: Lapp. Date: 1961-08-09. Reporter: Keating. Assignment: Zuma Beach. Special Instructions: Etc. 9/10: South of paved parking area. 65/66: Looking North, unpaved & to be paved this year. 63/64: Zuma Beach snack bar. Negs to Fred Kenne".Additional caption slip reads: "Photographer: Lapp. Date: 1961-08-09. Reporter: Keating. Assignment: Zuma Beach & LA Marina. 43/44: Westward, beach in foreground & Zuma Beach in background extending to bay. 67/68: Dominguez dump. Which is to be built a golf course."
DOI: 10.25549/examiner-c44-64628
title: Track -- pole vaulter, 1958

description: 6 images. Track -- pole vaulter, 14 February 1958. Jim Brewer. "Sports". (Sleeve reads: SP 12290).; Caption slip reads: "Photographer: Jensen. Assignment: USC Pole vaulter; national hi school record 15 1/8. 1-2-3-4-82-83: Jim Brewer".
DOI: 10.25549/examiner-c44-64319
title: Skiing -- Snow Valley, 1958

description: 88 images. Skiing -- Snow Valley, 12 February 1958. Frank Stevens; Garry McCulley; Bert Upson.; Caption slip reads: "Photographer: Jensen. Assignment: Snow Valley. Special instructions: 35 mm strips. Frank Stevens; over sprung; Garry McCulley; Gary; Frank; Bert Upson".
DOI: 10.25549/examiner-c44-70164
title: John Sparkman in Long Beach, 1952

description: 8 images. John Sparkman in Long Beach, 3 September 1952. John Sparkman (at "University by the Sea" on the beach known as "Spit N' Argue Club" with crowd of 1200.; Caption slip reads: "Photographer: Emery. Date: 1952-09-03. Reporter: Phister to Carl Greenberg. Assignment: John Sparkman, Demo, VP nominee, campaigning in Long Beach. 67: Old timers applauding Sparkman at 'University by the Sea' outdoor forum long known as 'Spit 'n' Argue Club'. 66/96/97/72/73/94/95: Various shots of Sparkman speaking -- crowd of 1200 listening".
DOI: 10.25549/examiner-c44-11023
title: Palm Springs flash flood, 1951

description: 5 images. Palm Springs flash flood, 28 July 1951. Flooded area and washed out sections of Highway 111 at Araby Point, and Rancho Mirage -- 8 miles southeast of Palm Springs.
DOI: 10.15468/dl.g47ysq
title: Occurrence Download

description: A dataset containing 95633 species occurrences available in GBIF matching the query:
{
 "and" : [
 "Country is Mexico",
 "TaxonKey is Quercus L."
 ]
}

 The dataset includes 95633 records from 267 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0018436-240506114902167/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.25549/examiner-c44-9829
title: Hi Neighbor Queen candidates, 1951

description: 4 images. Hi Neighbor Queen candidates, June 27, 1951. Neva Milligan; Ginger Smith; Carolyn Rennick; Ruth Phillips; Ellyn Lederer; Suzanne Cook; Ginger De Lisio; Jeanne Darr; Helen Rizio.; More descriptive information with originals.
DOI: 10.25549/examiner-c44-10709
title: Mocombo singer, 1951

description: 4 images. Mocombo singer, 24 July 1951. June Roselle; Judge Edward R. Brand; Charlie Morrison.
DOI: 10.25549/examiner-c44-70935
title: Seven college converence tea, 1958

description: 11 images. Seven college converence tea, 26 June 1958. Susan Brewer; Fran Padelford; Charlotte Low; Jon Heddon; Mrs. Morgan Padelford; Susan Straith; Gretchen Stroschein; Cynthia Perkins; Elizabeth Mayland; Tassie Wheelon; Susan Clark; Martha Cummings.; Caption slip reads: "Photographer: Wilson. Date: 1958-06-25. Reporter: 'Soc'. Assignment: College tea. 7: College party in Padelford garden. 55/56: Foreground left, 1 Susan Brewer, Westlake School L.A.; extreme left 2 Fran Padelford, Bishop School, Pasadena. 3 Charlotte Low, Mayfield, Pasadena. 4 Jon Hudson, Bishop School, Rancho Santa Fe. 5 Mrs. Morgan Padelford. 6 Susan Straith, Westlake School, L.A. 7 Gretchen Stroschein, Bishop, Santa Anna [sic]. These are girls interested in going East to one of the seven colleges -- Smith, Radcliffe, Bryn Maur, Mt. Holyoke, Barnard, Wellesley. On slips at 7 college party. 57/58: Jon Keddon, Susan Brewer, Gretchen Stroschein, Susan Straith, Fran Padelford".; Caption slip continues: "Seven College conference scholars: 00/01/31: L/R Cynthia Perkins from Claremont, granted scholarships by Wellesley College. Elizabeth Edmundson, head of upper school at Westridge in Pasadena, President of Radcliffe club of S. Calif. Leonora Navari from Long Beach received scholarship from Smith College. Elizabeth Mayland from Pasadena going to Bryn Maur College. Speaker on panel - 7 college party. 21/22: Tassie Wheelon goes to Wellesley College, lives in Los Angeles. 32/23/24: Left Susan Clark, Bishop School, La Habre; Mrs. Morgan Padelford; Martha Cummings, Marlborough, L.A.".; Supplementary material reads: "Photo assignment for Wednesday June 25 at 2:30 p.m. Page one layout part. Pls [sic] go to home of Mrs. Padelford, 385 North San Rafael, Pasadena, get shots of Seven College Conference tea. Candid, want two pix [sic], different set ups and different people. Mostly prospective or current college girls, and a couple of sponsors, including Mrs. Padelford. Close together, unaware of camera. Contacts early Thursday morning. Thanks Carter Ludlow".
DOI: 10.25549/examiner-c44-70913
title: Oakmont League, 1958

description: 3 images. Oakmont League, 8 July 1958. Mrs. John Pagliuso; Mrs. Kepler S. Robinson; Mrs. Forrest Hinkley.; Caption slip reads: "Photographer: Gray. Date: 1958-07-08. Reporter: 'Soc'. Assignment: 30: L to R Mrs. John Pagliuso; Mrs. Kepler S. Robinson; Mrs. Forrest Hinkley. Contacts please".; Supplementary material reads: "Ward club photo assignment for Tuesday July 8 at 3 p.m. Home of Mrs. Gordon Bartow, 940 Las Flores drive, Glendale, Citrus 62966. Oakmont League Hawaiian party (poolside shot, casual...) Release with story July 16. Mrs. Weston, Citrus 30817, is press chairman, handling picture arrangements".
DOI: 10.25549/examiner-c44-70189
title: Lung for 20 years, 1952

description: 2 images. Lung for 20 years, October 7 1952. Mrs. Marvin Hilleger; Celia Surovsky; Alice McLain; Supervisor Douglas Sanitarium.
DOI: 10.25549/examiner-c44-70574
title: Nixon at Ambassador Hotel, 1956

description: 2 images. Nixon at Ambassador Hotel, 28 October 1956. Edward Shattuck; Richard Nixon; Alphonso E. Bell; John Rousselot; V. John Krehbiel; James Reynolds; Franklin Donnell; Charles Ducommun.; Caption slip reads: "Photographer: Olmo. Date: 1956-10-28. Reporter: Sid Bernstein. Assignment: Nixon at Ambassador Hotel. 3-4-5: Left to Right: group shot of California Republican leaders in conference with vice president. Left to right, front row: John Rousselot, president of Cal. Young Republicans; V. John Krehbiel, chrm., Republican Central committee, LA County; Henry Kearns, chairman, Southern Cal. Eisenhower-Nixon Committee; Edward Shattuck, Republican National Committeeman; Nixon; Alphonzo Bell, chrm., Rep. State Central Committee; James Reynolds, chrm., Southern Cal. Citizens for Eisenhower. L to R, rear row: Franklin Donnell, United Republicans finance leader; Ed Valentine, co-chrm., United Rep.; Charles Ducommun, Southern Cal. tour committee chairman."
DOI: 10.25549/examiner-c44-70250
title: Marina negatives for Jack Keating series, 1961.

description: 3 images. Marina negatives for Jack Keating series, 14 August 1961. Marina in Playa Del Rey; Various views.; Supplementary material reads: "Marina pictures for Wednesday article in Keating recreation series. No. 16 was taken within the harbor on one of the big earth jetties on which will be built apartment houses, boatels, and a variety of other commercial projects to be operated or subleased, by promoters. The water around the jetties will be used for some 6100 individual yacht ships. No. 59 and 60 were taken from the top of a hill to the South of the Marina in Playa Del Rey and show the main entrance channel of the harbor in the foreground and the various jetties in the background. The Marina encompasses some 780 acres of land and water. No. 46 shows one of the uncompleted bays in the harbor on the North side next to Venice. It shows the huge banks of dredging mud which are being piled up on the perimeter -- about which Venice residents have protested, since it cuts off theur view of the harbor. In some places these banks are 30 feet high."
DOI: 10.25549/examiner-c44-10969
title: Fashion awards dinner at Ambassador, 1951

description: 10 images. Fashion awards dinner at Ambassador, 26 July 1951. Lee Page (model); Alvina Tomin (model); Dorothy Van Nuys (model); W.C. Wright; Evelyn Frey; Marilyn Simmons; Butch Brodbeck.; More descriptive information with originals.
DOI: 10.25549/examiner-c44-20767
title: Berserk man at Loma Linda Avenue and Serrano Street (Hollywood), 1951

description: 5 images. Berserk man at Loma Linda Avenue and Serrano Street (Hollywood), 27 September 1951. Robert C. Thompson -- 21 years; Thomas Isenberg (victim); Nurse Jackie Allensworth.
DOI: 10.25549/examiner-c44-75901
title: Finn twins at La Brea Hospital, 1954

description: 8 images. Finn twins at La Brea Hospital, 15 July 1954. George and Charles Finn; Mrs. Arlene Kelley; Mrs. Marvel Schuler; Patricia Lynn.; Caption slip reads: "Photographer: Paegel. Date: 1954-07-15. Reporter: T.T.. Assignment: Twin Finns at La Brea Hospital. 35/36: George Finn drinks milk at lunch-time in La Brea Hospital. 40: L to R - Charles Finn, Mrs. Arlene Kelley, Mrs. Marvel Schuler, Patricia Lynn & George Finn at La Brea Hospital."
DOI: 10.25549/examiner-c44-1371
title: Poultry round up (Richardson Hatchery in San Gabriel), 1948

description: 17 images. Poultry round up (Richardson Hatchery in San Gabriel), December 30, 1948. Fred Gahm (egg candling machine); Arnold Zander (sorts cockerels and pullets); Lee Pollard (culls baby chicks prior to shipping); Jeanne Elliott; "Henrietta" the hen.; More descriptive information with originals.
DOI: 10.25549/examiner-c44-20857
title: Society...Trojan Junior Auxiliary Membership Tea, 1951

description: 4 images. Society...Trojan Junior Auxiliary Membership Tea, 17 September 1951. Mrs. Daniel Smith; Mrs. Robert Beaudry; Miss Betty Bryan; Mrs. Hal Thomas; Mrs. Willard Monteith; Mrs. Jack Remp; Mrs. William Adams. (Sleeve reads: S9302).; Caption slip reads: "Photographer: Mercurio. Assignment: Society. 15/16: Mrs. Daniel Smith; Miss Betty Bryan; Mrs. Robt. Beaudry; Mrs. Willard Monteith. 11/12: Standing -- Mrs. Jack Remp; Mrs. Wm. Adams; Mrs. John Basler; standing -- Mrs. Robt. Beaudry; Mrs. Wm. Monteith".
DOI: 10.25549/examiner-c44-20753
title: Ashley Case, 1951

description: 2 images. Ashley Case, 27 September 1951. Mrs. Stella McArron (complaining witness).
DOI: 10.25549/examiner-c44-21034
title: Newspaper Night at Elks, 1951

description: 4 images. Newspaper Night at Elks, 03 October 1951. Dr. Clark Ryan (Exalted Ruler); Fred Tabery; Robert A. Mount (Business Manager of Examiner).; Caption slip reads: "Photographer: McCarty. Reporter: Looman. Assignment: Newspaper night at elks 99".
DOI: 10.25549/examiner-c44-10736
title: 63rd Annual Convention of Christian Churches of Southern California, 1951

description: 4 images. Sixty-third Annual Convention of Christian Churches of Southern California, 24 July 1951. Dr. Stephen J. England; Ronald Lemmex.; More descriptive information with originals.
DOI: 10.25549/examiner-c44-10733
title: Blacktop victim suit, 1951

description: 2 images. Blacktop victim suit, 20 July 1951. Segrid Pederson -- 6 years.; More descriptive information with originals.
DOI: 10.25549/examiner-c44-70429
title: Nixon tour-Santa Monica-Panorama City and stops between, 1961

description: 18 images. Nixon tour-Santa Monica-Panorama City and stops between, 29 November 1956. Vice President Richard Nixon; Edgar W. Hiestand (Congressman); Mrs. Dorothy Ann Fisher - 26 years; Clifford Coy; Robin Scott - 8 years; Mrs. Pat Nixon.; Caption slip reads: "Photographer: Olmo. Date: 1961-10-29. Reporter: Coughlin. Assignment: Nixon Tour. Nixon talks with polio victim Mrs. Dorothy Ann Fisher, 26, of Palmdale, in ambulance carrying her to Calif. Rehab Center in Santa Monica. Attendant in rear is Clifford Coy. Crowd greets Nixon at Pico blvd. and Overland ave. w/ signs, including "The Fighting 59th" (assembly district). In Santa Monica, Nixon talks with little Robin Scott, 8, of Santa Monica as he prepares to leave after speech. Crowd in Santa Monica listening to Nixon. Note Stevenson - and Kefauver banner in rear. Nixon with crowd of kids at Wilshire and 18th in Santa Monica. Nixon talks briefly with Santa Monica Technical School students en route to San Mon speech. L-R: Nixon is introduced in Panorama City by Congressman Edgar W. Hiestand".
DOI: 10.25549/examiner-c44-10107
title: Gypsies arrested for robbery (Hollywood Station), 1951

description: 5 images. Gypsies arrested for robbery (Hollywood Station), June 30, 1951. Frank Lee -- 50 years; Mada Lee -- 50 years; Leura Lee -- 18 years; Detective Mike Hunt.
DOI: 10.5281/zenodo.10710117
title: [Data set] Alloy  [FA,Cs]PbI3 Perovskite Surfaces, Stability and Tolerance to Defect Formation

description: This is the data repository related to the simulations of alloy [FA,Cs]PbI3 Perovskite Surfaces.

The surfaces here (Slabs.tgz) included are the relaxed structure of the slab models obtained by making cuts in the (001) direction in the special quasi-random structure (SQS) bulk models of FA1-xCsxPbI3 with (x=0.25 and 0.5), and the supercell models of pure FAPbI3 and CsPbI3 perovskites.[1] Besides, we include the optimized structures of each neutral vacancy pair defects (Slabs-defects.tgz) of formamidinium iodide and/or cesium iodide created in the most stable alloy [FA,Cs]I-C-FA0.75Cs0.25PbI3 surface (see details in the paper). The ionic relaxations were performed with VASP code (version 6.2.1), using the PBE exchange-correlation functional, including Van der Waals corrections using the Grimme method with zero-damping function.

Finally, the data set includes the simulated ab initio molecular dynamics (AIMD) trajectories of the most stable alloy and pure slabs, [FA,Cs]I-C-FA0.75Cs0.25PbI3  and FAI-PbI3), including neutral vacancy pair defects of formamidinium iodide on a surface (Slabs-defects-AIMD.tgz). The AIMD calculations were performed with the CP2K code (V7.1), evaluating the forces with the PBE functional with the Grimme correction scheme (DFT- D3, Zero–damped correction). The trajectory productions include up to 15 ps using the microcanonical ensemble with 0.5 fs of time-step, considering 5 ps of thermalization time. More details in the article support information. 

 

Reference:

1. G. M. Dalpian, X. G. Zhao, L. Kazmerski, A. Zunger, Chem. Mater. 31, 2497–2506 (2019).